long_animation.sdf 967 KB

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  1. RDKit 3D
  2. 11 11 0 0 0 0 0 0 0 0999 V2000
  3. -0.2702 1.1515 0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0
  4. -1.2785 0.1948 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
  5. -0.9129 -1.1405 -0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0
  6. 0.3682 -1.5691 -0.0711 N 0 0 0 0 0 0 0 0 0 0 0 0
  7. 1.3253 -0.6173 -0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0
  8. 1.0589 0.7412 0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0
  9. -0.5180 2.2078 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
  10. -2.3238 0.4819 0.0035 H 0 0 0 0 0 0 0 0 0 0 0 0
  11. -1.6631 -1.9247 -0.1047 H 0 0 0 0 0 0 0 0 0 0 0 0
  12. 2.3464 -0.9874 -0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0
  13. 1.8678 1.4617 0.0846 H 0 0 0 0 0 0 0 0 0 0 0 0
  14. 1 2 2 0
  15. 2 3 1 0
  16. 3 4 2 0
  17. 4 5 1 0
  18. 5 6 2 0
  19. 6 1 1 0
  20. 1 7 1 0
  21. 2 8 1 0
  22. 3 9 1 0
  23. 5 10 1 0
  24. 6 11 1 0
  25. M END
  26. $$$$
  27. RDKit 3D
  28. 11 11 0 0 0 0 0 0 0 0999 V2000
  29. -0.2702 1.1511 0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0
  30. -1.2785 0.1949 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
  31. -0.9129 -1.1401 -0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0
  32. 0.3682 -1.5686 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0
  33. 1.3253 -0.6172 -0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0
  34. 1.0589 0.7410 0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0
  35. -0.5180 2.2072 0.1139 H 0 0 0 0 0 0 0 0 0 0 0 0
  36. -2.3238 0.4819 0.0065 H 0 0 0 0 0 0 0 0 0 0 0 0
  37. -1.6631 -1.9240 -0.1168 H 0 0 0 0 0 0 0 0 0 0 0 0
  38. 2.3464 -0.9872 -0.0334 H 0 0 0 0 0 0 0 0 0 0 0 0
  39. 1.8678 1.4612 0.0937 H 0 0 0 0 0 0 0 0 0 0 0 0
  40. 1 2 2 0
  41. 2 3 1 0
  42. 3 4 2 0
  43. 4 5 1 0
  44. 5 6 2 0
  45. 6 1 1 0
  46. 1 7 1 0
  47. 2 8 1 0
  48. 3 9 1 0
  49. 5 10 1 0
  50. 6 11 1 0
  51. M END
  52. $$$$
  53. RDKit 3D
  54. 11 11 0 0 0 0 0 0 0 0999 V2000
  55. -0.2702 1.1507 0.0666 C 0 0 0 0 0 0 0 0 0 0 0 0
  56. -1.2785 0.1949 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0
  57. -0.9129 -1.1396 -0.0758 C 0 0 0 0 0 0 0 0 0 0 0 0
  58. 0.3682 -1.5681 -0.0908 N 0 0 0 0 0 0 0 0 0 0 0 0
  59. 1.3253 -0.6170 -0.0259 C 0 0 0 0 0 0 0 0 0 0 0 0
  60. 1.0589 0.7406 0.0531 C 0 0 0 0 0 0 0 0 0 0 0 0
  61. -0.5180 2.2064 0.1278 H 0 0 0 0 0 0 0 0 0 0 0 0
  62. -2.3238 0.4818 0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0
  63. -1.6631 -1.9232 -0.1289 H 0 0 0 0 0 0 0 0 0 0 0 0
  64. 2.3464 -0.9870 -0.0396 H 0 0 0 0 0 0 0 0 0 0 0 0
  65. 1.8678 1.4605 0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0
  66. 1 2 2 0
  67. 2 3 1 0
  68. 3 4 2 0
  69. 4 5 1 0
  70. 5 6 2 0
  71. 6 1 1 0
  72. 1 7 1 0
  73. 2 8 1 0
  74. 3 9 1 0
  75. 5 10 1 0
  76. 6 11 1 0
  77. M END
  78. $$$$
  79. RDKit 3D
  80. 11 11 0 0 0 0 0 0 0 0999 V2000
  81. -0.2702 1.1503 0.0739 C 0 0 0 0 0 0 0 0 0 0 0 0
  82. -1.2785 0.1948 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
  83. -0.9129 -1.1391 -0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0
  84. 0.3682 -1.5675 -0.1007 N 0 0 0 0 0 0 0 0 0 0 0 0
  85. 1.3253 -0.6168 -0.0298 C 0 0 0 0 0 0 0 0 0 0 0 0
  86. 1.0589 0.7403 0.0578 C 0 0 0 0 0 0 0 0 0 0 0 0
  87. -0.5180 2.2056 0.1416 H 0 0 0 0 0 0 0 0 0 0 0 0
  88. -2.3238 0.4817 0.0126 H 0 0 0 0 0 0 0 0 0 0 0 0
  89. -1.6631 -1.9224 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  90. 2.3464 -0.9867 -0.0458 H 0 0 0 0 0 0 0 0 0 0 0 0
  91. 1.8678 1.4599 0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0
  92. 1 2 2 0
  93. 2 3 1 0
  94. 3 4 2 0
  95. 4 5 1 0
  96. 5 6 2 0
  97. 6 1 1 0
  98. 1 7 1 0
  99. 2 8 1 0
  100. 3 9 1 0
  101. 5 10 1 0
  102. 6 11 1 0
  103. M END
  104. $$$$
  105. RDKit 3D
  106. 11 11 0 0 0 0 0 0 0 0999 V2000
  107. -0.2702 1.1498 0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0
  108. -1.2785 0.1948 0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0
  109. -0.9129 -1.1386 -0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
  110. 0.3682 -1.5668 -0.1105 N 0 0 0 0 0 0 0 0 0 0 0 0
  111. 1.3253 -0.6166 -0.0337 C 0 0 0 0 0 0 0 0 0 0 0 0
  112. 1.0589 0.7399 0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0
  113. -0.5180 2.2046 0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0
  114. -2.3238 0.4816 0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0
  115. -1.6631 -1.9214 -0.1531 H 0 0 0 0 0 0 0 0 0 0 0 0
  116. 2.3464 -0.9864 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0
  117. 1.8678 1.4591 0.1213 H 0 0 0 0 0 0 0 0 0 0 0 0
  118. 1 2 2 0
  119. 2 3 1 0
  120. 3 4 2 0
  121. 4 5 1 0
  122. 5 6 2 0
  123. 6 1 1 0
  124. 1 7 1 0
  125. 2 8 1 0
  126. 3 9 1 0
  127. 5 10 1 0
  128. 6 11 1 0
  129. M END
  130. $$$$
  131. RDKit 3D
  132. 11 11 0 0 0 0 0 0 0 0999 V2000
  133. -0.2702 1.1493 0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0
  134. -1.2785 0.1948 0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0
  135. -0.9129 -1.1380 -0.0973 C 0 0 0 0 0 0 0 0 0 0 0 0
  136. 0.3682 -1.5661 -0.1203 N 0 0 0 0 0 0 0 0 0 0 0 0
  137. 1.3253 -0.6164 -0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
  138. 1.0589 0.7395 0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0
  139. -0.5180 2.2036 0.1693 H 0 0 0 0 0 0 0 0 0 0 0 0
  140. -2.3238 0.4815 0.0186 H 0 0 0 0 0 0 0 0 0 0 0 0
  141. -1.6631 -1.9205 -0.1651 H 0 0 0 0 0 0 0 0 0 0 0 0
  142. 2.3464 -0.9861 -0.0582 H 0 0 0 0 0 0 0 0 0 0 0 0
  143. 1.8678 1.4583 0.1304 H 0 0 0 0 0 0 0 0 0 0 0 0
  144. 1 2 2 0
  145. 2 3 1 0
  146. 3 4 2 0
  147. 4 5 1 0
  148. 5 6 2 0
  149. 6 1 1 0
  150. 1 7 1 0
  151. 2 8 1 0
  152. 3 9 1 0
  153. 5 10 1 0
  154. 6 11 1 0
  155. M END
  156. $$$$
  157. RDKit 3D
  158. 11 11 0 0 0 0 0 0 0 0999 V2000
  159. -0.2702 1.1487 0.0955 C 0 0 0 0 0 0 0 0 0 0 0 0
  160. -1.2785 0.1948 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  161. -0.9129 -1.1374 -0.1044 C 0 0 0 0 0 0 0 0 0 0 0 0
  162. 0.3682 -1.5653 -0.1302 N 0 0 0 0 0 0 0 0 0 0 0 0
  163. 1.3253 -0.6162 -0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0
  164. 1.0589 0.7391 0.0717 C 0 0 0 0 0 0 0 0 0 0 0 0
  165. -0.5180 2.2025 0.1832 H 0 0 0 0 0 0 0 0 0 0 0 0
  166. -2.3238 0.4814 0.0217 H 0 0 0 0 0 0 0 0 0 0 0 0
  167. -1.6631 -1.9194 -0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0
  168. 2.3464 -0.9857 -0.0644 H 0 0 0 0 0 0 0 0 0 0 0 0
  169. 1.8678 1.4575 0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0
  170. 1 2 2 0
  171. 2 3 1 0
  172. 3 4 2 0
  173. 4 5 1 0
  174. 5 6 2 0
  175. 6 1 1 0
  176. 1 7 1 0
  177. 2 8 1 0
  178. 3 9 1 0
  179. 5 10 1 0
  180. 6 11 1 0
  181. M END
  182. $$$$
  183. RDKit 3D
  184. 11 11 0 0 0 0 0 0 0 0999 V2000
  185. -0.2702 1.1481 0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0
  186. -1.2785 0.1947 0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0
  187. -0.9129 -1.1367 -0.1115 C 0 0 0 0 0 0 0 0 0 0 0 0
  188. 0.3682 -1.5645 -0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0
  189. 1.3253 -0.6159 -0.0453 C 0 0 0 0 0 0 0 0 0 0 0 0
  190. 1.0589 0.7386 0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0
  191. -0.5180 2.2013 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0
  192. -2.3238 0.4813 0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0
  193. -1.6631 -1.9182 -0.1893 H 0 0 0 0 0 0 0 0 0 0 0 0
  194. 2.3464 -0.9853 -0.0706 H 0 0 0 0 0 0 0 0 0 0 0 0
  195. 1.8678 1.4566 0.1487 H 0 0 0 0 0 0 0 0 0 0 0 0
  196. 1 2 2 0
  197. 2 3 1 0
  198. 3 4 2 0
  199. 4 5 1 0
  200. 5 6 2 0
  201. 6 1 1 0
  202. 1 7 1 0
  203. 2 8 1 0
  204. 3 9 1 0
  205. 5 10 1 0
  206. 6 11 1 0
  207. M END
  208. $$$$
  209. RDKit 3D
  210. 11 11 0 0 0 0 0 0 0 0999 V2000
  211. -0.2702 1.1474 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0
  212. -1.2785 0.1947 0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
  213. -0.9129 -1.1360 -0.1187 C 0 0 0 0 0 0 0 0 0 0 0 0
  214. 0.3682 -1.5636 -0.1498 N 0 0 0 0 0 0 0 0 0 0 0 0
  215. 1.3253 -0.6156 -0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0
  216. 1.0589 0.7381 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0
  217. -0.5180 2.2000 0.2108 H 0 0 0 0 0 0 0 0 0 0 0 0
  218. -2.3238 0.4811 0.0277 H 0 0 0 0 0 0 0 0 0 0 0 0
  219. -1.6631 -1.9170 -0.2013 H 0 0 0 0 0 0 0 0 0 0 0 0
  220. 2.3464 -0.9848 -0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0
  221. 1.8678 1.4556 0.1579 H 0 0 0 0 0 0 0 0 0 0 0 0
  222. 1 2 2 0
  223. 2 3 1 0
  224. 3 4 2 0
  225. 4 5 1 0
  226. 5 6 2 0
  227. 6 1 1 0
  228. 1 7 1 0
  229. 2 8 1 0
  230. 3 9 1 0
  231. 5 10 1 0
  232. 6 11 1 0
  233. M END
  234. $$$$
  235. RDKit 3D
  236. 11 11 0 0 0 0 0 0 0 0999 V2000
  237. -0.2702 1.1467 0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0
  238. -1.2785 0.1946 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0
  239. -0.9129 -1.1352 -0.1258 C 0 0 0 0 0 0 0 0 0 0 0 0
  240. 0.3682 -1.5626 -0.1597 N 0 0 0 0 0 0 0 0 0 0 0 0
  241. 1.3253 -0.6153 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  242. 1.0589 0.7376 0.0856 C 0 0 0 0 0 0 0 0 0 0 0 0
  243. -0.5180 2.1987 0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0
  244. -2.3238 0.4809 0.0307 H 0 0 0 0 0 0 0 0 0 0 0 0
  245. -1.6631 -1.9157 -0.2134 H 0 0 0 0 0 0 0 0 0 0 0 0
  246. 2.3464 -0.9843 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0
  247. 1.8678 1.4546 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  248. 1 2 2 0
  249. 2 3 1 0
  250. 3 4 2 0
  251. 4 5 1 0
  252. 5 6 2 0
  253. 6 1 1 0
  254. 1 7 1 0
  255. 2 8 1 0
  256. 3 9 1 0
  257. 5 10 1 0
  258. 6 11 1 0
  259. M END
  260. $$$$
  261. RDKit 3D
  262. 11 11 0 0 0 0 0 0 0 0999 V2000
  263. -0.2702 1.1459 0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0
  264. -1.2785 0.1946 0.0108 C 0 0 0 0 0 0 0 0 0 0 0 0
  265. -0.9129 -1.1344 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0
  266. 0.3682 -1.5616 -0.1695 N 0 0 0 0 0 0 0 0 0 0 0 0
  267. 1.3253 -0.6149 -0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0
  268. 1.0589 0.7370 0.0903 C 0 0 0 0 0 0 0 0 0 0 0 0
  269. -0.5180 2.1972 0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0
  270. -2.3238 0.4807 0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0
  271. -1.6631 -1.9143 -0.2254 H 0 0 0 0 0 0 0 0 0 0 0 0
  272. 2.3464 -0.9838 -0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0
  273. 1.8678 1.4535 0.1762 H 0 0 0 0 0 0 0 0 0 0 0 0
  274. 1 2 2 0
  275. 2 3 1 0
  276. 3 4 2 0
  277. 4 5 1 0
  278. 5 6 2 0
  279. 6 1 1 0
  280. 1 7 1 0
  281. 2 8 1 0
  282. 3 9 1 0
  283. 5 10 1 0
  284. 6 11 1 0
  285. M END
  286. $$$$
  287. RDKit 3D
  288. 11 11 0 0 0 0 0 0 0 0999 V2000
  289. -0.2702 1.1451 0.1316 C 0 0 0 0 0 0 0 0 0 0 0 0
  290. -1.2785 0.1945 0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0
  291. -0.9129 -1.1335 -0.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
  292. 0.3682 -1.5605 -0.1793 N 0 0 0 0 0 0 0 0 0 0 0 0
  293. 1.3253 -0.6146 -0.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
  294. 1.0589 0.7365 0.0949 C 0 0 0 0 0 0 0 0 0 0 0 0
  295. -0.5180 2.1957 0.2523 H 0 0 0 0 0 0 0 0 0 0 0 0
  296. -2.3238 0.4805 0.0368 H 0 0 0 0 0 0 0 0 0 0 0 0
  297. -1.6631 -1.9129 -0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0
  298. 2.3464 -0.9832 -0.0953 H 0 0 0 0 0 0 0 0 0 0 0 0
  299. 1.8678 1.4524 0.1853 H 0 0 0 0 0 0 0 0 0 0 0 0
  300. 1 2 2 0
  301. 2 3 1 0
  302. 3 4 2 0
  303. 4 5 1 0
  304. 5 6 2 0
  305. 6 1 1 0
  306. 1 7 1 0
  307. 2 8 1 0
  308. 3 9 1 0
  309. 5 10 1 0
  310. 6 11 1 0
  311. M END
  312. $$$$
  313. RDKit 3D
  314. 11 11 0 0 0 0 0 0 0 0999 V2000
  315. -0.2702 1.1443 0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0
  316. -1.2785 0.1944 0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0
  317. -0.9129 -1.1326 -0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0
  318. 0.3682 -1.5593 -0.1891 N 0 0 0 0 0 0 0 0 0 0 0 0
  319. 1.3253 -0.6142 -0.0646 C 0 0 0 0 0 0 0 0 0 0 0 0
  320. 1.0589 0.7358 0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0
  321. -0.5180 2.1940 0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0
  322. -2.3238 0.4803 0.0398 H 0 0 0 0 0 0 0 0 0 0 0 0
  323. -1.6631 -1.9113 -0.2494 H 0 0 0 0 0 0 0 0 0 0 0 0
  324. 2.3464 -0.9826 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0
  325. 1.8678 1.4512 0.1944 H 0 0 0 0 0 0 0 0 0 0 0 0
  326. 1 2 2 0
  327. 2 3 1 0
  328. 3 4 2 0
  329. 4 5 1 0
  330. 5 6 2 0
  331. 6 1 1 0
  332. 1 7 1 0
  333. 2 8 1 0
  334. 3 9 1 0
  335. 5 10 1 0
  336. 6 11 1 0
  337. M END
  338. $$$$
  339. RDKit 3D
  340. 11 11 0 0 0 0 0 0 0 0999 V2000
  341. -0.2702 1.1434 0.1459 C 0 0 0 0 0 0 0 0 0 0 0 0
  342. -1.2785 0.1943 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0
  343. -0.9129 -1.1317 -0.1543 C 0 0 0 0 0 0 0 0 0 0 0 0
  344. 0.3682 -1.5581 -0.1989 N 0 0 0 0 0 0 0 0 0 0 0 0
  345. 1.3253 -0.6138 -0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0
  346. 1.0589 0.7352 0.1041 C 0 0 0 0 0 0 0 0 0 0 0 0
  347. -0.5180 2.1923 0.2798 H 0 0 0 0 0 0 0 0 0 0 0 0
  348. -2.3238 0.4800 0.0428 H 0 0 0 0 0 0 0 0 0 0 0 0
  349. -1.6631 -1.9097 -0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0
  350. 2.3464 -0.9819 -0.1077 H 0 0 0 0 0 0 0 0 0 0 0 0
  351. 1.8678 1.4500 0.2035 H 0 0 0 0 0 0 0 0 0 0 0 0
  352. 1 2 2 0
  353. 2 3 1 0
  354. 3 4 2 0
  355. 4 5 1 0
  356. 5 6 2 0
  357. 6 1 1 0
  358. 1 7 1 0
  359. 2 8 1 0
  360. 3 9 1 0
  361. 5 10 1 0
  362. 6 11 1 0
  363. M END
  364. $$$$
  365. RDKit 3D
  366. 11 11 0 0 0 0 0 0 0 0999 V2000
  367. -0.2702 1.1424 0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0
  368. -1.2785 0.1942 0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0
  369. -0.9129 -1.1307 -0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0
  370. 0.3682 -1.5568 -0.2087 N 0 0 0 0 0 0 0 0 0 0 0 0
  371. 1.3253 -0.6133 -0.0723 C 0 0 0 0 0 0 0 0 0 0 0 0
  372. 1.0589 0.7345 0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0
  373. -0.5180 2.1905 0.2936 H 0 0 0 0 0 0 0 0 0 0 0 0
  374. -2.3238 0.4797 0.0458 H 0 0 0 0 0 0 0 0 0 0 0 0
  375. -1.6631 -1.9080 -0.2734 H 0 0 0 0 0 0 0 0 0 0 0 0
  376. 2.3464 -0.9812 -0.1138 H 0 0 0 0 0 0 0 0 0 0 0 0
  377. 1.8678 1.4486 0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0
  378. 1 2 2 0
  379. 2 3 1 0
  380. 3 4 2 0
  381. 4 5 1 0
  382. 5 6 2 0
  383. 6 1 1 0
  384. 1 7 1 0
  385. 2 8 1 0
  386. 3 9 1 0
  387. 5 10 1 0
  388. 6 11 1 0
  389. M END
  390. $$$$
  391. RDKit 3D
  392. 11 11 0 0 0 0 0 0 0 0999 V2000
  393. -0.2702 1.1414 0.1603 C 0 0 0 0 0 0 0 0 0 0 0 0
  394. -1.2785 0.1941 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
  395. -0.9129 -1.1297 -0.1685 C 0 0 0 0 0 0 0 0 0 0 0 0
  396. 0.3682 -1.5555 -0.2184 N 0 0 0 0 0 0 0 0 0 0 0 0
  397. 1.3253 -0.6128 -0.0762 C 0 0 0 0 0 0 0 0 0 0 0 0
  398. 1.0589 0.7338 0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0
  399. -0.5180 2.1886 0.3074 H 0 0 0 0 0 0 0 0 0 0 0 0
  400. -2.3238 0.4794 0.0488 H 0 0 0 0 0 0 0 0 0 0 0 0
  401. -1.6631 -1.9063 -0.2854 H 0 0 0 0 0 0 0 0 0 0 0 0
  402. 2.3464 -0.9805 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0
  403. 1.8678 1.4473 0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0
  404. 1 2 2 0
  405. 2 3 1 0
  406. 3 4 2 0
  407. 4 5 1 0
  408. 5 6 2 0
  409. 6 1 1 0
  410. 1 7 1 0
  411. 2 8 1 0
  412. 3 9 1 0
  413. 5 10 1 0
  414. 6 11 1 0
  415. M END
  416. $$$$
  417. RDKit 3D
  418. 11 11 0 0 0 0 0 0 0 0999 V2000
  419. -0.2702 1.1404 0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0
  420. -1.2785 0.1940 0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0
  421. -0.9129 -1.1286 -0.1756 C 0 0 0 0 0 0 0 0 0 0 0 0
  422. 0.3682 -1.5541 -0.2282 N 0 0 0 0 0 0 0 0 0 0 0 0
  423. 1.3253 -0.6124 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  424. 1.0589 0.7331 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0
  425. -0.5180 2.1867 0.3211 H 0 0 0 0 0 0 0 0 0 0 0 0
  426. -2.3238 0.4791 0.0519 H 0 0 0 0 0 0 0 0 0 0 0 0
  427. -1.6631 -1.9045 -0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0
  428. 2.3464 -0.9797 -0.1262 H 0 0 0 0 0 0 0 0 0 0 0 0
  429. 1.8678 1.4459 0.2308 H 0 0 0 0 0 0 0 0 0 0 0 0
  430. 1 2 2 0
  431. 2 3 1 0
  432. 3 4 2 0
  433. 4 5 1 0
  434. 5 6 2 0
  435. 6 1 1 0
  436. 1 7 1 0
  437. 2 8 1 0
  438. 3 9 1 0
  439. 5 10 1 0
  440. 6 11 1 0
  441. M END
  442. $$$$
  443. RDKit 3D
  444. 11 11 0 0 0 0 0 0 0 0999 V2000
  445. -0.2702 1.1393 0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
  446. -1.2785 0.1939 0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0
  447. -0.9129 -1.1274 -0.1827 C 0 0 0 0 0 0 0 0 0 0 0 0
  448. 0.3682 -1.5526 -0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0
  449. 1.3253 -0.6118 -0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0
  450. 1.0589 0.7324 0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0
  451. -0.5180 2.1846 0.3348 H 0 0 0 0 0 0 0 0 0 0 0 0
  452. -2.3238 0.4788 0.0549 H 0 0 0 0 0 0 0 0 0 0 0 0
  453. -1.6631 -1.9026 -0.3093 H 0 0 0 0 0 0 0 0 0 0 0 0
  454. 2.3464 -0.9789 -0.1323 H 0 0 0 0 0 0 0 0 0 0 0 0
  455. 1.8678 1.4444 0.2399 H 0 0 0 0 0 0 0 0 0 0 0 0
  456. 1 2 2 0
  457. 2 3 1 0
  458. 3 4 2 0
  459. 4 5 1 0
  460. 5 6 2 0
  461. 6 1 1 0
  462. 1 7 1 0
  463. 2 8 1 0
  464. 3 9 1 0
  465. 5 10 1 0
  466. 6 11 1 0
  467. M END
  468. $$$$
  469. RDKit 3D
  470. 11 11 0 0 0 0 0 0 0 0999 V2000
  471. -0.2702 1.1382 0.1818 C 0 0 0 0 0 0 0 0 0 0 0 0
  472. -1.2785 0.1938 0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0
  473. -0.9129 -1.1263 -0.1898 C 0 0 0 0 0 0 0 0 0 0 0 0
  474. 0.3682 -1.5511 -0.2477 N 0 0 0 0 0 0 0 0 0 0 0 0
  475. 1.3253 -0.6113 -0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0
  476. 1.0589 0.7316 0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0
  477. -0.5180 2.1824 0.3486 H 0 0 0 0 0 0 0 0 0 0 0 0
  478. -2.3238 0.4784 0.0579 H 0 0 0 0 0 0 0 0 0 0 0 0
  479. -1.6631 -1.9006 -0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0
  480. 2.3464 -0.9780 -0.1385 H 0 0 0 0 0 0 0 0 0 0 0 0
  481. 1.8678 1.4428 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0
  482. 1 2 2 0
  483. 2 3 1 0
  484. 3 4 2 0
  485. 4 5 1 0
  486. 5 6 2 0
  487. 6 1 1 0
  488. 1 7 1 0
  489. 2 8 1 0
  490. 3 9 1 0
  491. 5 10 1 0
  492. 6 11 1 0
  493. M END
  494. $$$$
  495. RDKit 3D
  496. 11 11 0 0 0 0 0 0 0 0999 V2000
  497. -0.2702 1.1370 0.1889 C 0 0 0 0 0 0 0 0 0 0 0 0
  498. -1.2785 0.1936 0.0218 C 0 0 0 0 0 0 0 0 0 0 0 0
  499. -0.9129 -1.1251 -0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0
  500. 0.3682 -1.5495 -0.2575 N 0 0 0 0 0 0 0 0 0 0 0 0
  501. 1.3253 -0.6107 -0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
  502. 1.0589 0.7308 0.1318 C 0 0 0 0 0 0 0 0 0 0 0 0
  503. -0.5180 2.1802 0.3623 H 0 0 0 0 0 0 0 0 0 0 0 0
  504. -2.3238 0.4780 0.0609 H 0 0 0 0 0 0 0 0 0 0 0 0
  505. -1.6631 -1.8985 -0.3332 H 0 0 0 0 0 0 0 0 0 0 0 0
  506. 2.3464 -0.9771 -0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0
  507. 1.8678 1.4412 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  508. 1 2 2 0
  509. 2 3 1 0
  510. 3 4 2 0
  511. 4 5 1 0
  512. 5 6 2 0
  513. 6 1 1 0
  514. 1 7 1 0
  515. 2 8 1 0
  516. 3 9 1 0
  517. 5 10 1 0
  518. 6 11 1 0
  519. M END
  520. $$$$
  521. RDKit 3D
  522. 11 11 0 0 0 0 0 0 0 0999 V2000
  523. -0.2702 1.1358 0.1961 C 0 0 0 0 0 0 0 0 0 0 0 0
  524. -1.2785 0.1935 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  525. -0.9129 -1.1238 -0.2039 C 0 0 0 0 0 0 0 0 0 0 0 0
  526. 0.3682 -1.5478 -0.2672 N 0 0 0 0 0 0 0 0 0 0 0 0
  527. 1.3253 -0.6101 -0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0
  528. 1.0589 0.7299 0.1364 C 0 0 0 0 0 0 0 0 0 0 0 0
  529. -0.5180 2.1779 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0
  530. -2.3238 0.4776 0.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
  531. -1.6631 -1.8964 -0.3451 H 0 0 0 0 0 0 0 0 0 0 0 0
  532. 2.3464 -0.9762 -0.1507 H 0 0 0 0 0 0 0 0 0 0 0 0
  533. 1.8678 1.4396 0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0
  534. 1 2 2 0
  535. 2 3 1 0
  536. 3 4 2 0
  537. 4 5 1 0
  538. 5 6 2 0
  539. 6 1 1 0
  540. 1 7 1 0
  541. 2 8 1 0
  542. 3 9 1 0
  543. 5 10 1 0
  544. 6 11 1 0
  545. M END
  546. $$$$
  547. RDKit 3D
  548. 11 11 0 0 0 0 0 0 0 0999 V2000
  549. -0.2702 1.1346 0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0
  550. -1.2785 0.1933 0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0
  551. -0.9129 -1.1225 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0
  552. 0.3682 -1.5461 -0.2769 N 0 0 0 0 0 0 0 0 0 0 0 0
  553. 1.3253 -0.6095 -0.0992 C 0 0 0 0 0 0 0 0 0 0 0 0
  554. 1.0589 0.7290 0.1409 C 0 0 0 0 0 0 0 0 0 0 0 0
  555. -0.5180 2.1755 0.3896 H 0 0 0 0 0 0 0 0 0 0 0 0
  556. -2.3238 0.4772 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0
  557. -1.6631 -1.8942 -0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0
  558. 2.3464 -0.9752 -0.1569 H 0 0 0 0 0 0 0 0 0 0 0 0
  559. 1.8678 1.4379 0.2761 H 0 0 0 0 0 0 0 0 0 0 0 0
  560. 1 2 2 0
  561. 2 3 1 0
  562. 3 4 2 0
  563. 4 5 1 0
  564. 5 6 2 0
  565. 6 1 1 0
  566. 1 7 1 0
  567. 2 8 1 0
  568. 3 9 1 0
  569. 5 10 1 0
  570. 6 11 1 0
  571. M END
  572. $$$$
  573. RDKit 3D
  574. 11 11 0 0 0 0 0 0 0 0999 V2000
  575. -0.2702 1.1333 0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0
  576. -1.2785 0.1932 0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0
  577. -0.9129 -1.1212 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
  578. 0.3682 -1.5444 -0.2866 N 0 0 0 0 0 0 0 0 0 0 0 0
  579. 1.3253 -0.6089 -0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0
  580. 1.0589 0.7281 0.1455 C 0 0 0 0 0 0 0 0 0 0 0 0
  581. -0.5180 2.1730 0.4033 H 0 0 0 0 0 0 0 0 0 0 0 0
  582. -2.3238 0.4768 0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0
  583. -1.6631 -1.8919 -0.3689 H 0 0 0 0 0 0 0 0 0 0 0 0
  584. 2.3464 -0.9742 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  585. 1.8678 1.4361 0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0
  586. 1 2 2 0
  587. 2 3 1 0
  588. 3 4 2 0
  589. 4 5 1 0
  590. 5 6 2 0
  591. 6 1 1 0
  592. 1 7 1 0
  593. 2 8 1 0
  594. 3 9 1 0
  595. 5 10 1 0
  596. 6 11 1 0
  597. M END
  598. $$$$
  599. RDKit 3D
  600. 11 11 0 0 0 0 0 0 0 0999 V2000
  601. -0.2702 1.1319 0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0
  602. -1.2785 0.1930 0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0
  603. -0.9129 -1.1198 -0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0
  604. 0.3682 -1.5425 -0.2963 N 0 0 0 0 0 0 0 0 0 0 0 0
  605. 1.3253 -0.6082 -0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0
  606. 1.0589 0.7272 0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0
  607. -0.5180 2.1704 0.4169 H 0 0 0 0 0 0 0 0 0 0 0 0
  608. -2.3238 0.4764 0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0
  609. -1.6631 -1.8895 -0.3808 H 0 0 0 0 0 0 0 0 0 0 0 0
  610. 2.3464 -0.9732 -0.1691 H 0 0 0 0 0 0 0 0 0 0 0 0
  611. 1.8678 1.4343 0.2942 H 0 0 0 0 0 0 0 0 0 0 0 0
  612. 1 2 2 0
  613. 2 3 1 0
  614. 3 4 2 0
  615. 4 5 1 0
  616. 5 6 2 0
  617. 6 1 1 0
  618. 1 7 1 0
  619. 2 8 1 0
  620. 3 9 1 0
  621. 5 10 1 0
  622. 6 11 1 0
  623. M END
  624. $$$$
  625. RDKit 3D
  626. 11 11 0 0 0 0 0 0 0 0999 V2000
  627. -0.2702 1.1306 0.2246 C 0 0 0 0 0 0 0 0 0 0 0 0
  628. -1.2785 0.1928 0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0
  629. -0.9129 -1.1183 -0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
  630. 0.3682 -1.5406 -0.3060 N 0 0 0 0 0 0 0 0 0 0 0 0
  631. 1.3253 -0.6076 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
  632. 1.0589 0.7263 0.1547 C 0 0 0 0 0 0 0 0 0 0 0 0
  633. -0.5180 2.1678 0.4306 H 0 0 0 0 0 0 0 0 0 0 0 0
  634. -2.3238 0.4759 0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0
  635. -1.6631 -1.8871 -0.3927 H 0 0 0 0 0 0 0 0 0 0 0 0
  636. 2.3464 -0.9721 -0.1752 H 0 0 0 0 0 0 0 0 0 0 0 0
  637. 1.8678 1.4324 0.3032 H 0 0 0 0 0 0 0 0 0 0 0 0
  638. 1 2 2 0
  639. 2 3 1 0
  640. 3 4 2 0
  641. 4 5 1 0
  642. 5 6 2 0
  643. 6 1 1 0
  644. 1 7 1 0
  645. 2 8 1 0
  646. 3 9 1 0
  647. 5 10 1 0
  648. 6 11 1 0
  649. M END
  650. $$$$
  651. RDKit 3D
  652. 11 11 0 0 0 0 0 0 0 0999 V2000
  653. -0.2702 1.1291 0.2317 C 0 0 0 0 0 0 0 0 0 0 0 0
  654. -1.2785 0.1927 0.0291 C 0 0 0 0 0 0 0 0 0 0 0 0
  655. -0.9129 -1.1168 -0.2391 C 0 0 0 0 0 0 0 0 0 0 0 0
  656. 0.3682 -1.5387 -0.3157 N 0 0 0 0 0 0 0 0 0 0 0 0
  657. 1.3253 -0.6068 -0.1145 C 0 0 0 0 0 0 0 0 0 0 0 0
  658. 1.0589 0.7253 0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0
  659. -0.5180 2.1650 0.4442 H 0 0 0 0 0 0 0 0 0 0 0 0
  660. -2.3238 0.4754 0.0788 H 0 0 0 0 0 0 0 0 0 0 0 0
  661. -1.6631 -1.8846 -0.4045 H 0 0 0 0 0 0 0 0 0 0 0 0
  662. 2.3464 -0.9710 -0.1813 H 0 0 0 0 0 0 0 0 0 0 0 0
  663. 1.8678 1.4305 0.3122 H 0 0 0 0 0 0 0 0 0 0 0 0
  664. 1 2 2 0
  665. 2 3 1 0
  666. 3 4 2 0
  667. 4 5 1 0
  668. 5 6 2 0
  669. 6 1 1 0
  670. 1 7 1 0
  671. 2 8 1 0
  672. 3 9 1 0
  673. 5 10 1 0
  674. 6 11 1 0
  675. M END
  676. $$$$
  677. RDKit 3D
  678. 11 11 0 0 0 0 0 0 0 0999 V2000
  679. -0.2702 1.1276 0.2387 C 0 0 0 0 0 0 0 0 0 0 0 0
  680. -1.2785 0.1925 0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0
  681. -0.9129 -1.1153 -0.2461 C 0 0 0 0 0 0 0 0 0 0 0 0
  682. 0.3682 -1.5367 -0.3253 N 0 0 0 0 0 0 0 0 0 0 0 0
  683. 1.3253 -0.6061 -0.1183 C 0 0 0 0 0 0 0 0 0 0 0 0
  684. 1.0589 0.7243 0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0
  685. -0.5180 2.1622 0.4578 H 0 0 0 0 0 0 0 0 0 0 0 0
  686. -2.3238 0.4749 0.0818 H 0 0 0 0 0 0 0 0 0 0 0 0
  687. -1.6631 -1.8820 -0.4164 H 0 0 0 0 0 0 0 0 0 0 0 0
  688. 2.3464 -0.9698 -0.1874 H 0 0 0 0 0 0 0 0 0 0 0 0
  689. 1.8678 1.4285 0.3212 H 0 0 0 0 0 0 0 0 0 0 0 0
  690. 1 2 2 0
  691. 2 3 1 0
  692. 3 4 2 0
  693. 4 5 1 0
  694. 5 6 2 0
  695. 6 1 1 0
  696. 1 7 1 0
  697. 2 8 1 0
  698. 3 9 1 0
  699. 5 10 1 0
  700. 6 11 1 0
  701. M END
  702. $$$$
  703. RDKit 3D
  704. 11 11 0 0 0 0 0 0 0 0999 V2000
  705. -0.2702 1.1261 0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0
  706. -1.2785 0.1923 0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0
  707. -0.9129 -1.1137 -0.2531 C 0 0 0 0 0 0 0 0 0 0 0 0
  708. 0.3682 -1.5346 -0.3350 N 0 0 0 0 0 0 0 0 0 0 0 0
  709. 1.3253 -0.6054 -0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0
  710. 1.0589 0.7232 0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
  711. -0.5180 2.1593 0.4714 H 0 0 0 0 0 0 0 0 0 0 0 0
  712. -2.3238 0.4744 0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0
  713. -1.6631 -1.8794 -0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0
  714. 2.3464 -0.9686 -0.1935 H 0 0 0 0 0 0 0 0 0 0 0 0
  715. 1.8678 1.4265 0.3301 H 0 0 0 0 0 0 0 0 0 0 0 0
  716. 1 2 2 0
  717. 2 3 1 0
  718. 3 4 2 0
  719. 4 5 1 0
  720. 5 6 2 0
  721. 6 1 1 0
  722. 1 7 1 0
  723. 2 8 1 0
  724. 3 9 1 0
  725. 5 10 1 0
  726. 6 11 1 0
  727. M END
  728. $$$$
  729. RDKit 3D
  730. 11 11 0 0 0 0 0 0 0 0999 V2000
  731. -0.2702 1.1246 0.2529 C 0 0 0 0 0 0 0 0 0 0 0 0
  732. -1.2785 0.1921 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0
  733. -0.9129 -1.1121 -0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0
  734. 0.3682 -1.5325 -0.3446 N 0 0 0 0 0 0 0 0 0 0 0 0
  735. 1.3253 -0.6046 -0.1259 C 0 0 0 0 0 0 0 0 0 0 0 0
  736. 1.0589 0.7221 0.1729 C 0 0 0 0 0 0 0 0 0 0 0 0
  737. -0.5180 2.1563 0.4849 H 0 0 0 0 0 0 0 0 0 0 0 0
  738. -2.3238 0.4738 0.0878 H 0 0 0 0 0 0 0 0 0 0 0 0
  739. -1.6631 -1.8766 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  740. 2.3464 -0.9674 -0.1996 H 0 0 0 0 0 0 0 0 0 0 0 0
  741. 1.8678 1.4244 0.3391 H 0 0 0 0 0 0 0 0 0 0 0 0
  742. 1 2 2 0
  743. 2 3 1 0
  744. 3 4 2 0
  745. 4 5 1 0
  746. 5 6 2 0
  747. 6 1 1 0
  748. 1 7 1 0
  749. 2 8 1 0
  750. 3 9 1 0
  751. 5 10 1 0
  752. 6 11 1 0
  753. M END
  754. $$$$
  755. RDKit 3D
  756. 11 11 0 0 0 0 0 0 0 0999 V2000
  757. -0.2702 1.1229 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0
  758. -1.2785 0.1919 0.0339 C 0 0 0 0 0 0 0 0 0 0 0 0
  759. -0.9129 -1.1105 -0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0
  760. 0.3682 -1.5303 -0.3543 N 0 0 0 0 0 0 0 0 0 0 0 0
  761. 1.3253 -0.6038 -0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  762. 1.0589 0.7210 0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0
  763. -0.5180 2.1532 0.4985 H 0 0 0 0 0 0 0 0 0 0 0 0
  764. -2.3238 0.4733 0.0908 H 0 0 0 0 0 0 0 0 0 0 0 0
  765. -1.6631 -1.8738 -0.4518 H 0 0 0 0 0 0 0 0 0 0 0 0
  766. 2.3464 -0.9661 -0.2057 H 0 0 0 0 0 0 0 0 0 0 0 0
  767. 1.8678 1.4222 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0
  768. 1 2 2 0
  769. 2 3 1 0
  770. 3 4 2 0
  771. 4 5 1 0
  772. 5 6 2 0
  773. 6 1 1 0
  774. 1 7 1 0
  775. 2 8 1 0
  776. 3 9 1 0
  777. 5 10 1 0
  778. 6 11 1 0
  779. M END
  780. $$$$
  781. RDKit 3D
  782. 11 11 0 0 0 0 0 0 0 0999 V2000
  783. -0.2702 1.1213 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0
  784. -1.2785 0.1917 0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0
  785. -0.9129 -1.1088 -0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0
  786. 0.3682 -1.5280 -0.3639 N 0 0 0 0 0 0 0 0 0 0 0 0
  787. 1.3253 -0.6030 -0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
  788. 1.0589 0.7199 0.1819 C 0 0 0 0 0 0 0 0 0 0 0 0
  789. -0.5180 2.1500 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0
  790. -2.3238 0.4727 0.0937 H 0 0 0 0 0 0 0 0 0 0 0 0
  791. -1.6631 -1.8710 -0.4635 H 0 0 0 0 0 0 0 0 0 0 0 0
  792. 2.3464 -0.9648 -0.2117 H 0 0 0 0 0 0 0 0 0 0 0 0
  793. 1.8678 1.4200 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0
  794. 1 2 2 0
  795. 2 3 1 0
  796. 3 4 2 0
  797. 4 5 1 0
  798. 5 6 2 0
  799. 6 1 1 0
  800. 1 7 1 0
  801. 2 8 1 0
  802. 3 9 1 0
  803. 5 10 1 0
  804. 6 11 1 0
  805. M END
  806. $$$$
  807. RDKit 3D
  808. 11 11 0 0 0 0 0 0 0 0999 V2000
  809. -0.2702 1.1196 0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0
  810. -1.2785 0.1914 0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0
  811. -0.9129 -1.1070 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0
  812. 0.3682 -1.5257 -0.3735 N 0 0 0 0 0 0 0 0 0 0 0 0
  813. 1.3253 -0.6021 -0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0
  814. 1.0589 0.7188 0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0
  815. -0.5180 2.1467 0.5255 H 0 0 0 0 0 0 0 0 0 0 0 0
  816. -2.3238 0.4721 0.0967 H 0 0 0 0 0 0 0 0 0 0 0 0
  817. -1.6631 -1.8680 -0.4753 H 0 0 0 0 0 0 0 0 0 0 0 0
  818. 2.3464 -0.9635 -0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0
  819. 1.8678 1.4177 0.3659 H 0 0 0 0 0 0 0 0 0 0 0 0
  820. 1 2 2 0
  821. 2 3 1 0
  822. 3 4 2 0
  823. 4 5 1 0
  824. 5 6 2 0
  825. 6 1 1 0
  826. 1 7 1 0
  827. 2 8 1 0
  828. 3 9 1 0
  829. 5 10 1 0
  830. 6 11 1 0
  831. M END
  832. $$$$
  833. RDKit 3D
  834. 11 11 0 0 0 0 0 0 0 0999 V2000
  835. -0.2702 1.1178 0.2811 C 0 0 0 0 0 0 0 0 0 0 0 0
  836. -1.2785 0.1912 0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
  837. -0.9129 -1.1052 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  838. 0.3682 -1.5233 -0.3830 N 0 0 0 0 0 0 0 0 0 0 0 0
  839. 1.3253 -0.6012 -0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0
  840. 1.0589 0.7176 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
  841. -0.5180 2.1434 0.5389 H 0 0 0 0 0 0 0 0 0 0 0 0
  842. -2.3238 0.4715 0.0997 H 0 0 0 0 0 0 0 0 0 0 0 0
  843. -1.6631 -1.8650 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0
  844. 2.3464 -0.9621 -0.2239 H 0 0 0 0 0 0 0 0 0 0 0 0
  845. 1.8678 1.4154 0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0
  846. 1 2 2 0
  847. 2 3 1 0
  848. 3 4 2 0
  849. 4 5 1 0
  850. 5 6 2 0
  851. 6 1 1 0
  852. 1 7 1 0
  853. 2 8 1 0
  854. 3 9 1 0
  855. 5 10 1 0
  856. 6 11 1 0
  857. M END
  858. $$$$
  859. RDKit 3D
  860. 11 11 0 0 0 0 0 0 0 0999 V2000
  861. -0.2702 1.1161 0.2881 C 0 0 0 0 0 0 0 0 0 0 0 0
  862. -1.2785 0.1910 0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0
  863. -0.9129 -1.1034 -0.2949 C 0 0 0 0 0 0 0 0 0 0 0 0
  864. 0.3682 -1.5209 -0.3926 N 0 0 0 0 0 0 0 0 0 0 0 0
  865. 1.3253 -0.6003 -0.1449 C 0 0 0 0 0 0 0 0 0 0 0 0
  866. 1.0589 0.7164 0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0
  867. -0.5180 2.1400 0.5524 H 0 0 0 0 0 0 0 0 0 0 0 0
  868. -2.3238 0.4708 0.1026 H 0 0 0 0 0 0 0 0 0 0 0 0
  869. -1.6631 -1.8619 -0.4987 H 0 0 0 0 0 0 0 0 0 0 0 0
  870. 2.3464 -0.9607 -0.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
  871. 1.8678 1.4130 0.3837 H 0 0 0 0 0 0 0 0 0 0 0 0
  872. 1 2 2 0
  873. 2 3 1 0
  874. 3 4 2 0
  875. 4 5 1 0
  876. 5 6 2 0
  877. 6 1 1 0
  878. 1 7 1 0
  879. 2 8 1 0
  880. 3 9 1 0
  881. 5 10 1 0
  882. 6 11 1 0
  883. M END
  884. $$$$
  885. RDKit 3D
  886. 11 11 0 0 0 0 0 0 0 0999 V2000
  887. -0.2702 1.1142 0.2951 C 0 0 0 0 0 0 0 0 0 0 0 0
  888. -1.2785 0.1907 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  889. -0.9129 -1.1015 -0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0
  890. 0.3682 -1.5184 -0.4021 N 0 0 0 0 0 0 0 0 0 0 0 0
  891. 1.3253 -0.5994 -0.1486 C 0 0 0 0 0 0 0 0 0 0 0 0
  892. 1.0589 0.7151 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0
  893. -0.5180 2.1364 0.5658 H 0 0 0 0 0 0 0 0 0 0 0 0
  894. -2.3238 0.4702 0.1056 H 0 0 0 0 0 0 0 0 0 0 0 0
  895. -1.6631 -1.8587 -0.5104 H 0 0 0 0 0 0 0 0 0 0 0 0
  896. 2.3464 -0.9592 -0.2359 H 0 0 0 0 0 0 0 0 0 0 0 0
  897. 1.8678 1.4106 0.3925 H 0 0 0 0 0 0 0 0 0 0 0 0
  898. 1 2 2 0
  899. 2 3 1 0
  900. 3 4 2 0
  901. 4 5 1 0
  902. 5 6 2 0
  903. 6 1 1 0
  904. 1 7 1 0
  905. 2 8 1 0
  906. 3 9 1 0
  907. 5 10 1 0
  908. 6 11 1 0
  909. M END
  910. $$$$
  911. RDKit 3D
  912. 11 11 0 0 0 0 0 0 0 0999 V2000
  913. -0.2702 1.1123 0.3021 C 0 0 0 0 0 0 0 0 0 0 0 0
  914. -1.2785 0.1905 0.0411 C 0 0 0 0 0 0 0 0 0 0 0 0
  915. -0.9129 -1.0996 -0.3088 C 0 0 0 0 0 0 0 0 0 0 0 0
  916. 0.3682 -1.5158 -0.4117 N 0 0 0 0 0 0 0 0 0 0 0 0
  917. 1.3253 -0.5985 -0.1524 C 0 0 0 0 0 0 0 0 0 0 0 0
  918. 1.0589 0.7138 0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0
  919. -0.5180 2.1328 0.5793 H 0 0 0 0 0 0 0 0 0 0 0 0
  920. -2.3238 0.4695 0.1085 H 0 0 0 0 0 0 0 0 0 0 0 0
  921. -1.6631 -1.8555 -0.5221 H 0 0 0 0 0 0 0 0 0 0 0 0
  922. 2.3464 -0.9577 -0.2419 H 0 0 0 0 0 0 0 0 0 0 0 0
  923. 1.8678 1.4081 0.4014 H 0 0 0 0 0 0 0 0 0 0 0 0
  924. 1 2 2 0
  925. 2 3 1 0
  926. 3 4 2 0
  927. 4 5 1 0
  928. 5 6 2 0
  929. 6 1 1 0
  930. 1 7 1 0
  931. 2 8 1 0
  932. 3 9 1 0
  933. 5 10 1 0
  934. 6 11 1 0
  935. M END
  936. $$$$
  937. RDKit 3D
  938. 11 11 0 0 0 0 0 0 0 0999 V2000
  939. -0.2702 1.1104 0.3091 C 0 0 0 0 0 0 0 0 0 0 0 0
  940. -1.2785 0.1902 0.0423 C 0 0 0 0 0 0 0 0 0 0 0 0
  941. -0.9129 -1.0977 -0.3157 C 0 0 0 0 0 0 0 0 0 0 0 0
  942. 0.3682 -1.5132 -0.4212 N 0 0 0 0 0 0 0 0 0 0 0 0
  943. 1.3253 -0.5975 -0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0
  944. 1.0589 0.7125 0.2089 C 0 0 0 0 0 0 0 0 0 0 0 0
  945. -0.5180 2.1292 0.5926 H 0 0 0 0 0 0 0 0 0 0 0 0
  946. -2.3238 0.4688 0.1115 H 0 0 0 0 0 0 0 0 0 0 0 0
  947. -1.6631 -1.8522 -0.5337 H 0 0 0 0 0 0 0 0 0 0 0 0
  948. 2.3464 -0.9562 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
  949. 1.8678 1.4055 0.4102 H 0 0 0 0 0 0 0 0 0 0 0 0
  950. 1 2 2 0
  951. 2 3 1 0
  952. 3 4 2 0
  953. 4 5 1 0
  954. 5 6 2 0
  955. 6 1 1 0
  956. 1 7 1 0
  957. 2 8 1 0
  958. 3 9 1 0
  959. 5 10 1 0
  960. 6 11 1 0
  961. M END
  962. $$$$
  963. RDKit 3D
  964. 11 11 0 0 0 0 0 0 0 0999 V2000
  965. -0.2702 1.1085 0.3161 C 0 0 0 0 0 0 0 0 0 0 0 0
  966. -1.2785 0.1899 0.0435 C 0 0 0 0 0 0 0 0 0 0 0 0
  967. -0.9129 -1.0957 -0.3226 C 0 0 0 0 0 0 0 0 0 0 0 0
  968. 0.3682 -1.5105 -0.4307 N 0 0 0 0 0 0 0 0 0 0 0 0
  969. 1.3253 -0.5965 -0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0
  970. 1.0589 0.7112 0.2134 C 0 0 0 0 0 0 0 0 0 0 0 0
  971. -0.5180 2.1254 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
  972. -2.3238 0.4681 0.1144 H 0 0 0 0 0 0 0 0 0 0 0 0
  973. -1.6631 -1.8488 -0.5454 H 0 0 0 0 0 0 0 0 0 0 0 0
  974. 2.3464 -0.9546 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  975. 1.8678 1.4029 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0
  976. 1 2 2 0
  977. 2 3 1 0
  978. 3 4 2 0
  979. 4 5 1 0
  980. 5 6 2 0
  981. 6 1 1 0
  982. 1 7 1 0
  983. 2 8 1 0
  984. 3 9 1 0
  985. 5 10 1 0
  986. 6 11 1 0
  987. M END
  988. $$$$
  989. RDKit 3D
  990. 11 11 0 0 0 0 0 0 0 0999 V2000
  991. -0.2702 1.1065 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0
  992. -1.2785 0.1896 0.0447 C 0 0 0 0 0 0 0 0 0 0 0 0
  993. -0.9129 -1.0936 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0
  994. 0.3682 -1.5078 -0.4402 N 0 0 0 0 0 0 0 0 0 0 0 0
  995. 1.3253 -0.5955 -0.1637 C 0 0 0 0 0 0 0 0 0 0 0 0
  996. 1.0589 0.7099 0.2179 C 0 0 0 0 0 0 0 0 0 0 0 0
  997. -0.5180 2.1216 0.6193 H 0 0 0 0 0 0 0 0 0 0 0 0
  998. -2.3238 0.4674 0.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
  999. -1.6631 -1.8453 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
  1000. 2.3464 -0.9530 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0
  1001. 1.8678 1.4003 0.4279 H 0 0 0 0 0 0 0 0 0 0 0 0
  1002. 1 2 2 0
  1003. 2 3 1 0
  1004. 3 4 2 0
  1005. 4 5 1 0
  1006. 5 6 2 0
  1007. 6 1 1 0
  1008. 1 7 1 0
  1009. 2 8 1 0
  1010. 3 9 1 0
  1011. 5 10 1 0
  1012. 6 11 1 0
  1013. M END
  1014. $$$$
  1015. RDKit 3D
  1016. 11 11 0 0 0 0 0 0 0 0999 V2000
  1017. -0.2702 1.1044 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
  1018. -1.2785 0.1894 0.0459 C 0 0 0 0 0 0 0 0 0 0 0 0
  1019. -0.9129 -1.0915 -0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0
  1020. 0.3682 -1.5050 -0.4496 N 0 0 0 0 0 0 0 0 0 0 0 0
  1021. 1.3253 -0.5944 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0
  1022. 1.0589 0.7085 0.2223 C 0 0 0 0 0 0 0 0 0 0 0 0
  1023. -0.5180 2.1176 0.6327 H 0 0 0 0 0 0 0 0 0 0 0 0
  1024. -2.3238 0.4666 0.1203 H 0 0 0 0 0 0 0 0 0 0 0 0
  1025. -1.6631 -1.8418 -0.5685 H 0 0 0 0 0 0 0 0 0 0 0 0
  1026. 2.3464 -0.9513 -0.2659 H 0 0 0 0 0 0 0 0 0 0 0 0
  1027. 1.8678 1.3975 0.4366 H 0 0 0 0 0 0 0 0 0 0 0 0
  1028. 1 2 2 0
  1029. 2 3 1 0
  1030. 3 4 2 0
  1031. 4 5 1 0
  1032. 5 6 2 0
  1033. 6 1 1 0
  1034. 1 7 1 0
  1035. 2 8 1 0
  1036. 3 9 1 0
  1037. 5 10 1 0
  1038. 6 11 1 0
  1039. M END
  1040. $$$$
  1041. RDKit 3D
  1042. 11 11 0 0 0 0 0 0 0 0999 V2000
  1043. -0.2702 1.1023 0.3369 C 0 0 0 0 0 0 0 0 0 0 0 0
  1044. -1.2785 0.1891 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
  1045. -0.9129 -1.0894 -0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0
  1046. 0.3682 -1.5021 -0.4591 N 0 0 0 0 0 0 0 0 0 0 0 0
  1047. 1.3253 -0.5934 -0.1711 C 0 0 0 0 0 0 0 0 0 0 0 0
  1048. 1.0589 0.7071 0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0
  1049. -0.5180 2.1136 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0
  1050. -2.3238 0.4659 0.1232 H 0 0 0 0 0 0 0 0 0 0 0 0
  1051. -1.6631 -1.8382 -0.5801 H 0 0 0 0 0 0 0 0 0 0 0 0
  1052. 2.3464 -0.9496 -0.2719 H 0 0 0 0 0 0 0 0 0 0 0 0
  1053. 1.8678 1.3948 0.4454 H 0 0 0 0 0 0 0 0 0 0 0 0
  1054. 1 2 2 0
  1055. 2 3 1 0
  1056. 3 4 2 0
  1057. 4 5 1 0
  1058. 5 6 2 0
  1059. 6 1 1 0
  1060. 1 7 1 0
  1061. 2 8 1 0
  1062. 3 9 1 0
  1063. 5 10 1 0
  1064. 6 11 1 0
  1065. M END
  1066. $$$$
  1067. RDKit 3D
  1068. 11 11 0 0 0 0 0 0 0 0999 V2000
  1069. -0.2702 1.1002 0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0
  1070. -1.2785 0.1888 0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0
  1071. -0.9129 -1.0872 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0
  1072. 0.3682 -1.4992 -0.4685 N 0 0 0 0 0 0 0 0 0 0 0 0
  1073. 1.3253 -0.5923 -0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0
  1074. 1.0589 0.7056 0.2312 C 0 0 0 0 0 0 0 0 0 0 0 0
  1075. -0.5180 2.1095 0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0
  1076. -2.3238 0.4651 0.1262 H 0 0 0 0 0 0 0 0 0 0 0 0
  1077. -1.6631 -1.8345 -0.5916 H 0 0 0 0 0 0 0 0 0 0 0 0
  1078. 2.3464 -0.9479 -0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
  1079. 1.8678 1.3919 0.4542 H 0 0 0 0 0 0 0 0 0 0 0 0
  1080. 1 2 2 0
  1081. 2 3 1 0
  1082. 3 4 2 0
  1083. 4 5 1 0
  1084. 5 6 2 0
  1085. 6 1 1 0
  1086. 1 7 1 0
  1087. 2 8 1 0
  1088. 3 9 1 0
  1089. 5 10 1 0
  1090. 6 11 1 0
  1091. M END
  1092. $$$$
  1093. RDKit 3D
  1094. 11 11 0 0 0 0 0 0 0 0999 V2000
  1095. -0.2702 1.0980 0.3507 C 0 0 0 0 0 0 0 0 0 0 0 0
  1096. -1.2785 0.1885 0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0
  1097. -0.9129 -1.0850 -0.3568 C 0 0 0 0 0 0 0 0 0 0 0 0
  1098. 0.3682 -1.4963 -0.4779 N 0 0 0 0 0 0 0 0 0 0 0 0
  1099. 1.3253 -0.5912 -0.1786 C 0 0 0 0 0 0 0 0 0 0 0 0
  1100. 1.0589 0.7042 0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0
  1101. -0.5180 2.1053 0.6725 H 0 0 0 0 0 0 0 0 0 0 0 0
  1102. -2.3238 0.4643 0.1291 H 0 0 0 0 0 0 0 0 0 0 0 0
  1103. -1.6631 -1.8307 -0.6032 H 0 0 0 0 0 0 0 0 0 0 0 0
  1104. 2.3464 -0.9461 -0.2838 H 0 0 0 0 0 0 0 0 0 0 0 0
  1105. 1.8678 1.3891 0.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
  1106. 1 2 2 0
  1107. 2 3 1 0
  1108. 3 4 2 0
  1109. 4 5 1 0
  1110. 5 6 2 0
  1111. 6 1 1 0
  1112. 1 7 1 0
  1113. 2 8 1 0
  1114. 3 9 1 0
  1115. 5 10 1 0
  1116. 6 11 1 0
  1117. M END
  1118. $$$$
  1119. RDKit 3D
  1120. 11 11 0 0 0 0 0 0 0 0999 V2000
  1121. -0.2702 1.0958 0.3576 C 0 0 0 0 0 0 0 0 0 0 0 0
  1122. -1.2785 0.1882 0.0507 C 0 0 0 0 0 0 0 0 0 0 0 0
  1123. -0.9129 -1.0827 -0.3636 C 0 0 0 0 0 0 0 0 0 0 0 0
  1124. 0.3682 -1.4932 -0.4873 N 0 0 0 0 0 0 0 0 0 0 0 0
  1125. 1.3253 -0.5900 -0.1823 C 0 0 0 0 0 0 0 0 0 0 0 0
  1126. 1.0589 0.7027 0.2401 C 0 0 0 0 0 0 0 0 0 0 0 0
  1127. -0.5180 2.1010 0.6857 H 0 0 0 0 0 0 0 0 0 0 0 0
  1128. -2.3238 0.4635 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0
  1129. -1.6631 -1.8269 -0.6146 H 0 0 0 0 0 0 0 0 0 0 0 0
  1130. 2.3464 -0.9443 -0.2898 H 0 0 0 0 0 0 0 0 0 0 0 0
  1131. 1.8678 1.3861 0.4716 H 0 0 0 0 0 0 0 0 0 0 0 0
  1132. 1 2 2 0
  1133. 2 3 1 0
  1134. 3 4 2 0
  1135. 4 5 1 0
  1136. 5 6 2 0
  1137. 6 1 1 0
  1138. 1 7 1 0
  1139. 2 8 1 0
  1140. 3 9 1 0
  1141. 5 10 1 0
  1142. 6 11 1 0
  1143. M END
  1144. $$$$
  1145. RDKit 3D
  1146. 11 11 0 0 0 0 0 0 0 0999 V2000
  1147. -0.2702 1.0935 0.3645 C 0 0 0 0 0 0 0 0 0 0 0 0
  1148. -1.2785 0.1878 0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0
  1149. -0.9129 -1.0804 -0.3704 C 0 0 0 0 0 0 0 0 0 0 0 0
  1150. 0.3682 -1.4901 -0.4967 N 0 0 0 0 0 0 0 0 0 0 0 0
  1151. 1.3253 -0.5889 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  1152. 1.0589 0.7011 0.2445 C 0 0 0 0 0 0 0 0 0 0 0 0
  1153. -0.5180 2.0967 0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
  1154. -2.3238 0.4626 0.1349 H 0 0 0 0 0 0 0 0 0 0 0 0
  1155. -1.6631 -1.8230 -0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0
  1156. 2.3464 -0.9425 -0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0
  1157. 1.8678 1.3831 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
  1158. 1 2 2 0
  1159. 2 3 1 0
  1160. 3 4 2 0
  1161. 4 5 1 0
  1162. 5 6 2 0
  1163. 6 1 1 0
  1164. 1 7 1 0
  1165. 2 8 1 0
  1166. 3 9 1 0
  1167. 5 10 1 0
  1168. 6 11 1 0
  1169. M END
  1170. $$$$
  1171. RDKit 3D
  1172. 11 11 0 0 0 0 0 0 0 0999 V2000
  1173. -0.2702 1.0912 0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0
  1174. -1.2785 0.1875 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  1175. -0.9129 -1.0781 -0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0
  1176. 0.3682 -1.4870 -0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0
  1177. 1.3253 -0.5877 -0.1897 C 0 0 0 0 0 0 0 0 0 0 0 0
  1178. 1.0589 0.6996 0.2489 C 0 0 0 0 0 0 0 0 0 0 0 0
  1179. -0.5180 2.0923 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0
  1180. -2.3238 0.4618 0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0
  1181. -1.6631 -1.8190 -0.6376 H 0 0 0 0 0 0 0 0 0 0 0 0
  1182. 2.3464 -0.9406 -0.3016 H 0 0 0 0 0 0 0 0 0 0 0 0
  1183. 1.8678 1.3801 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1184. 1 2 2 0
  1185. 2 3 1 0
  1186. 3 4 2 0
  1187. 4 5 1 0
  1188. 5 6 2 0
  1189. 6 1 1 0
  1190. 1 7 1 0
  1191. 2 8 1 0
  1192. 3 9 1 0
  1193. 5 10 1 0
  1194. 6 11 1 0
  1195. M END
  1196. $$$$
  1197. RDKit 3D
  1198. 11 11 0 0 0 0 0 0 0 0999 V2000
  1199. -0.2702 1.0888 0.3782 C 0 0 0 0 0 0 0 0 0 0 0 0
  1200. -1.2785 0.1872 0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0
  1201. -0.9129 -1.0757 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0
  1202. 0.3682 -1.4838 -0.5154 N 0 0 0 0 0 0 0 0 0 0 0 0
  1203. 1.3253 -0.5865 -0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0
  1204. 1.0589 0.6980 0.2533 C 0 0 0 0 0 0 0 0 0 0 0 0
  1205. -0.5180 2.0878 0.7252 H 0 0 0 0 0 0 0 0 0 0 0 0
  1206. -2.3238 0.4609 0.1407 H 0 0 0 0 0 0 0 0 0 0 0 0
  1207. -1.6631 -1.8150 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0
  1208. 2.3464 -0.9387 -0.3075 H 0 0 0 0 0 0 0 0 0 0 0 0
  1209. 1.8678 1.3770 0.4977 H 0 0 0 0 0 0 0 0 0 0 0 0
  1210. 1 2 2 0
  1211. 2 3 1 0
  1212. 3 4 2 0
  1213. 4 5 1 0
  1214. 5 6 2 0
  1215. 6 1 1 0
  1216. 1 7 1 0
  1217. 2 8 1 0
  1218. 3 9 1 0
  1219. 5 10 1 0
  1220. 6 11 1 0
  1221. M END
  1222. $$$$
  1223. RDKit 3D
  1224. 11 11 0 0 0 0 0 0 0 0999 V2000
  1225. -0.2702 1.0864 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0
  1226. -1.2785 0.1868 0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0
  1227. -0.9129 -1.0732 -0.3907 C 0 0 0 0 0 0 0 0 0 0 0 0
  1228. 0.3682 -1.4805 -0.5247 N 0 0 0 0 0 0 0 0 0 0 0 0
  1229. 1.3253 -0.5853 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
  1230. 1.0589 0.6964 0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0
  1231. -0.5180 2.0832 0.7383 H 0 0 0 0 0 0 0 0 0 0 0 0
  1232. -2.3238 0.4600 0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0
  1233. -1.6631 -1.8109 -0.6604 H 0 0 0 0 0 0 0 0 0 0 0 0
  1234. 2.3464 -0.9368 -0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0
  1235. 1.8678 1.3738 0.5063 H 0 0 0 0 0 0 0 0 0 0 0 0
  1236. 1 2 2 0
  1237. 2 3 1 0
  1238. 3 4 2 0
  1239. 4 5 1 0
  1240. 5 6 2 0
  1241. 6 1 1 0
  1242. 1 7 1 0
  1243. 2 8 1 0
  1244. 3 9 1 0
  1245. 5 10 1 0
  1246. 6 11 1 0
  1247. M END
  1248. $$$$
  1249. RDKit 3D
  1250. 11 11 0 0 0 0 0 0 0 0999 V2000
  1251. -0.2702 1.0840 0.3918 C 0 0 0 0 0 0 0 0 0 0 0 0
  1252. -1.2785 0.1865 0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0
  1253. -0.9129 -1.0708 -0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0
  1254. 0.3682 -1.4772 -0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0
  1255. 1.3253 -0.5840 -0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0
  1256. 1.0589 0.6948 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0
  1257. -0.5180 2.0785 0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0
  1258. -2.3238 0.4591 0.1465 H 0 0 0 0 0 0 0 0 0 0 0 0
  1259. -1.6631 -1.8067 -0.6717 H 0 0 0 0 0 0 0 0 0 0 0 0
  1260. 2.3464 -0.9348 -0.3193 H 0 0 0 0 0 0 0 0 0 0 0 0
  1261. 1.8678 1.3706 0.5149 H 0 0 0 0 0 0 0 0 0 0 0 0
  1262. 1 2 2 0
  1263. 2 3 1 0
  1264. 3 4 2 0
  1265. 4 5 1 0
  1266. 5 6 2 0
  1267. 6 1 1 0
  1268. 1 7 1 0
  1269. 2 8 1 0
  1270. 3 9 1 0
  1271. 5 10 1 0
  1272. 6 11 1 0
  1273. M END
  1274. $$$$
  1275. RDKit 3D
  1276. 11 11 0 0 0 0 0 0 0 0999 V2000
  1277. -0.2702 1.0815 0.3987 C 0 0 0 0 0 0 0 0 0 0 0 0
  1278. -1.2785 0.1861 0.0577 C 0 0 0 0 0 0 0 0 0 0 0 0
  1279. -0.9129 -1.0682 -0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0
  1280. 0.3682 -1.4738 -0.5433 N 0 0 0 0 0 0 0 0 0 0 0 0
  1281. 1.3253 -0.5828 -0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0
  1282. 1.0589 0.6931 0.2664 C 0 0 0 0 0 0 0 0 0 0 0 0
  1283. -0.5180 2.0737 0.7644 H 0 0 0 0 0 0 0 0 0 0 0 0
  1284. -2.3238 0.4582 0.1494 H 0 0 0 0 0 0 0 0 0 0 0 0
  1285. -1.6631 -1.8024 -0.6831 H 0 0 0 0 0 0 0 0 0 0 0 0
  1286. 2.3464 -0.9327 -0.3251 H 0 0 0 0 0 0 0 0 0 0 0 0
  1287. 1.8678 1.3674 0.5235 H 0 0 0 0 0 0 0 0 0 0 0 0
  1288. 1 2 2 0
  1289. 2 3 1 0
  1290. 3 4 2 0
  1291. 4 5 1 0
  1292. 5 6 2 0
  1293. 6 1 1 0
  1294. 1 7 1 0
  1295. 2 8 1 0
  1296. 3 9 1 0
  1297. 5 10 1 0
  1298. 6 11 1 0
  1299. M END
  1300. $$$$
  1301. RDKit 3D
  1302. 11 11 0 0 0 0 0 0 0 0999 V2000
  1303. -0.2702 1.0790 0.4054 C 0 0 0 0 0 0 0 0 0 0 0 0
  1304. -1.2785 0.1857 0.0589 C 0 0 0 0 0 0 0 0 0 0 0 0
  1305. -0.9129 -1.0657 -0.4109 C 0 0 0 0 0 0 0 0 0 0 0 0
  1306. 0.3682 -1.4703 -0.5525 N 0 0 0 0 0 0 0 0 0 0 0 0
  1307. 1.3253 -0.5815 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
  1308. 1.0589 0.6914 0.2707 C 0 0 0 0 0 0 0 0 0 0 0 0
  1309. -0.5180 2.0689 0.7774 H 0 0 0 0 0 0 0 0 0 0 0 0
  1310. -2.3238 0.4572 0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0
  1311. -1.6631 -1.7981 -0.6944 H 0 0 0 0 0 0 0 0 0 0 0 0
  1312. 2.3464 -0.9307 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0
  1313. 1.8678 1.3641 0.5321 H 0 0 0 0 0 0 0 0 0 0 0 0
  1314. 1 2 2 0
  1315. 2 3 1 0
  1316. 3 4 2 0
  1317. 4 5 1 0
  1318. 5 6 2 0
  1319. 6 1 1 0
  1320. 1 7 1 0
  1321. 2 8 1 0
  1322. 3 9 1 0
  1323. 5 10 1 0
  1324. 6 11 1 0
  1325. M END
  1326. $$$$
  1327. RDKit 3D
  1328. 11 11 0 0 0 0 0 0 0 0999 V2000
  1329. -0.2702 1.0764 0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0
  1330. -1.2785 0.1854 0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
  1331. -0.9129 -1.0631 -0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0
  1332. 0.3682 -1.4668 -0.5617 N 0 0 0 0 0 0 0 0 0 0 0 0
  1333. 1.3253 -0.5801 -0.2117 C 0 0 0 0 0 0 0 0 0 0 0 0
  1334. 1.0589 0.6897 0.2751 C 0 0 0 0 0 0 0 0 0 0 0 0
  1335. -0.5180 2.0639 0.7904 H 0 0 0 0 0 0 0 0 0 0 0 0
  1336. -2.3238 0.4563 0.1551 H 0 0 0 0 0 0 0 0 0 0 0 0
  1337. -1.6631 -1.7937 -0.7057 H 0 0 0 0 0 0 0 0 0 0 0 0
  1338. 2.3464 -0.9286 -0.3368 H 0 0 0 0 0 0 0 0 0 0 0 0
  1339. 1.8678 1.3607 0.5407 H 0 0 0 0 0 0 0 0 0 0 0 0
  1340. 1 2 2 0
  1341. 2 3 1 0
  1342. 3 4 2 0
  1343. 4 5 1 0
  1344. 5 6 2 0
  1345. 6 1 1 0
  1346. 1 7 1 0
  1347. 2 8 1 0
  1348. 3 9 1 0
  1349. 5 10 1 0
  1350. 6 11 1 0
  1351. M END
  1352. $$$$
  1353. RDKit 3D
  1354. 11 11 0 0 0 0 0 0 0 0999 V2000
  1355. -0.2702 1.0738 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0
  1356. -1.2785 0.1850 0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0
  1357. -0.9129 -1.0604 -0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0
  1358. 0.3682 -1.4633 -0.5709 N 0 0 0 0 0 0 0 0 0 0 0 0
  1359. 1.3253 -0.5788 -0.2153 C 0 0 0 0 0 0 0 0 0 0 0 0
  1360. 1.0589 0.6880 0.2794 C 0 0 0 0 0 0 0 0 0 0 0 0
  1361. -0.5180 2.0589 0.8033 H 0 0 0 0 0 0 0 0 0 0 0 0
  1362. -2.3238 0.4553 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0
  1363. -1.6631 -1.7893 -0.7169 H 0 0 0 0 0 0 0 0 0 0 0 0
  1364. 2.3464 -0.9264 -0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0
  1365. 1.8678 1.3573 0.5492 H 0 0 0 0 0 0 0 0 0 0 0 0
  1366. 1 2 2 0
  1367. 2 3 1 0
  1368. 3 4 2 0
  1369. 4 5 1 0
  1370. 5 6 2 0
  1371. 6 1 1 0
  1372. 1 7 1 0
  1373. 2 8 1 0
  1374. 3 9 1 0
  1375. 5 10 1 0
  1376. 6 11 1 0
  1377. M END
  1378. $$$$
  1379. RDKit 3D
  1380. 11 11 0 0 0 0 0 0 0 0999 V2000
  1381. -0.2702 1.0711 0.4257 C 0 0 0 0 0 0 0 0 0 0 0 0
  1382. -1.2785 0.1846 0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0
  1383. -0.9129 -1.0578 -0.4309 C 0 0 0 0 0 0 0 0 0 0 0 0
  1384. 0.3682 -1.4597 -0.5801 N 0 0 0 0 0 0 0 0 0 0 0 0
  1385. 1.3253 -0.5774 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0
  1386. 1.0589 0.6862 0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0
  1387. -0.5180 2.0538 0.8163 H 0 0 0 0 0 0 0 0 0 0 0 0
  1388. -2.3238 0.4543 0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0
  1389. -1.6631 -1.7847 -0.7281 H 0 0 0 0 0 0 0 0 0 0 0 0
  1390. 2.3464 -0.9243 -0.3485 H 0 0 0 0 0 0 0 0 0 0 0 0
  1391. 1.8678 1.3538 0.5577 H 0 0 0 0 0 0 0 0 0 0 0 0
  1392. 1 2 2 0
  1393. 2 3 1 0
  1394. 3 4 2 0
  1395. 4 5 1 0
  1396. 5 6 2 0
  1397. 6 1 1 0
  1398. 1 7 1 0
  1399. 2 8 1 0
  1400. 3 9 1 0
  1401. 5 10 1 0
  1402. 6 11 1 0
  1403. M END
  1404. $$$$
  1405. RDKit 3D
  1406. 11 11 0 0 0 0 0 0 0 0999 V2000
  1407. -0.2702 1.0685 0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0
  1408. -1.2785 0.1842 0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0
  1409. -0.9129 -1.0550 -0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0
  1410. 0.3682 -1.4560 -0.5893 N 0 0 0 0 0 0 0 0 0 0 0 0
  1411. 1.3253 -0.5760 -0.2226 C 0 0 0 0 0 0 0 0 0 0 0 0
  1412. 1.0589 0.6844 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  1413. -0.5180 2.0487 0.8291 H 0 0 0 0 0 0 0 0 0 0 0 0
  1414. -2.3238 0.4532 0.1637 H 0 0 0 0 0 0 0 0 0 0 0 0
  1415. -1.6631 -1.7801 -0.7393 H 0 0 0 0 0 0 0 0 0 0 0 0
  1416. 2.3464 -0.9221 -0.3543 H 0 0 0 0 0 0 0 0 0 0 0 0
  1417. 1.8678 1.3502 0.5662 H 0 0 0 0 0 0 0 0 0 0 0 0
  1418. 1 2 2 0
  1419. 2 3 1 0
  1420. 3 4 2 0
  1421. 4 5 1 0
  1422. 5 6 2 0
  1423. 6 1 1 0
  1424. 1 7 1 0
  1425. 2 8 1 0
  1426. 3 9 1 0
  1427. 5 10 1 0
  1428. 6 11 1 0
  1429. M END
  1430. $$$$
  1431. RDKit 3D
  1432. 11 11 0 0 0 0 0 0 0 0999 V2000
  1433. -0.2702 1.0657 0.4391 C 0 0 0 0 0 0 0 0 0 0 0 0
  1434. -1.2785 0.1838 0.0647 C 0 0 0 0 0 0 0 0 0 0 0 0
  1435. -0.9129 -1.0523 -0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0
  1436. 0.3682 -1.4523 -0.5984 N 0 0 0 0 0 0 0 0 0 0 0 0
  1437. 1.3253 -0.5746 -0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0
  1438. 1.0589 0.6826 0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0
  1439. -0.5180 2.0434 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0
  1440. -2.3238 0.4522 0.1665 H 0 0 0 0 0 0 0 0 0 0 0 0
  1441. -1.6631 -1.7754 -0.7505 H 0 0 0 0 0 0 0 0 0 0 0 0
  1442. 2.3464 -0.9198 -0.3601 H 0 0 0 0 0 0 0 0 0 0 0 0
  1443. 1.8678 1.3467 0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0
  1444. 1 2 2 0
  1445. 2 3 1 0
  1446. 3 4 2 0
  1447. 4 5 1 0
  1448. 5 6 2 0
  1449. 6 1 1 0
  1450. 1 7 1 0
  1451. 2 8 1 0
  1452. 3 9 1 0
  1453. 5 10 1 0
  1454. 6 11 1 0
  1455. M END
  1456. $$$$
  1457. RDKit 3D
  1458. 11 11 0 0 0 0 0 0 0 0999 V2000
  1459. -0.2702 1.0629 0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0
  1460. -1.2785 0.1834 0.0658 C 0 0 0 0 0 0 0 0 0 0 0 0
  1461. -0.9129 -1.0494 -0.4508 C 0 0 0 0 0 0 0 0 0 0 0 0
  1462. 0.3682 -1.4485 -0.6075 N 0 0 0 0 0 0 0 0 0 0 0 0
  1463. 1.3253 -0.5732 -0.2298 C 0 0 0 0 0 0 0 0 0 0 0 0
  1464. 1.0589 0.6807 0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0
  1465. -0.5180 2.0381 0.8548 H 0 0 0 0 0 0 0 0 0 0 0 0
  1466. -2.3238 0.4512 0.1694 H 0 0 0 0 0 0 0 0 0 0 0 0
  1467. -1.6631 -1.7707 -0.7617 H 0 0 0 0 0 0 0 0 0 0 0 0
  1468. 2.3464 -0.9175 -0.3658 H 0 0 0 0 0 0 0 0 0 0 0 0
  1469. 1.8678 1.3430 0.5831 H 0 0 0 0 0 0 0 0 0 0 0 0
  1470. 1 2 2 0
  1471. 2 3 1 0
  1472. 3 4 2 0
  1473. 4 5 1 0
  1474. 5 6 2 0
  1475. 6 1 1 0
  1476. 1 7 1 0
  1477. 2 8 1 0
  1478. 3 9 1 0
  1479. 5 10 1 0
  1480. 6 11 1 0
  1481. M END
  1482. $$$$
  1483. RDKit 3D
  1484. 11 11 0 0 0 0 0 0 0 0999 V2000
  1485. -0.2702 1.0601 0.4525 C 0 0 0 0 0 0 0 0 0 0 0 0
  1486. -1.2785 0.1830 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0
  1487. -0.9129 -1.0466 -0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0
  1488. 0.3682 -1.4446 -0.6166 N 0 0 0 0 0 0 0 0 0 0 0 0
  1489. 1.3253 -0.5718 -0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0
  1490. 1.0589 0.6789 0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0
  1491. -0.5180 2.0327 0.8676 H 0 0 0 0 0 0 0 0 0 0 0 0
  1492. -2.3238 0.4501 0.1722 H 0 0 0 0 0 0 0 0 0 0 0 0
  1493. -1.6631 -1.7659 -0.7728 H 0 0 0 0 0 0 0 0 0 0 0 0
  1494. 2.3464 -0.9152 -0.3716 H 0 0 0 0 0 0 0 0 0 0 0 0
  1495. 1.8678 1.3393 0.5916 H 0 0 0 0 0 0 0 0 0 0 0 0
  1496. 1 2 2 0
  1497. 2 3 1 0
  1498. 3 4 2 0
  1499. 4 5 1 0
  1500. 5 6 2 0
  1501. 6 1 1 0
  1502. 1 7 1 0
  1503. 2 8 1 0
  1504. 3 9 1 0
  1505. 5 10 1 0
  1506. 6 11 1 0
  1507. M END
  1508. $$$$
  1509. RDKit 3D
  1510. 11 11 0 0 0 0 0 0 0 0999 V2000
  1511. -0.2702 1.0572 0.4591 C 0 0 0 0 0 0 0 0 0 0 0 0
  1512. -1.2785 0.1825 0.0681 C 0 0 0 0 0 0 0 0 0 0 0 0
  1513. -0.9129 -1.0437 -0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0
  1514. 0.3682 -1.4407 -0.6257 N 0 0 0 0 0 0 0 0 0 0 0 0
  1515. 1.3253 -0.5703 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
  1516. 1.0589 0.6770 0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0
  1517. -0.5180 2.0272 0.8804 H 0 0 0 0 0 0 0 0 0 0 0 0
  1518. -2.3238 0.4490 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0
  1519. -1.6631 -1.7610 -0.7838 H 0 0 0 0 0 0 0 0 0 0 0 0
  1520. 2.3464 -0.9129 -0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0
  1521. 1.8678 1.3356 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1522. 1 2 2 0
  1523. 2 3 1 0
  1524. 3 4 2 0
  1525. 4 5 1 0
  1526. 5 6 2 0
  1527. 6 1 1 0
  1528. 1 7 1 0
  1529. 2 8 1 0
  1530. 3 9 1 0
  1531. 5 10 1 0
  1532. 6 11 1 0
  1533. M END
  1534. $$$$
  1535. RDKit 3D
  1536. 11 11 0 0 0 0 0 0 0 0999 V2000
  1537. -0.2702 1.0543 0.4658 C 0 0 0 0 0 0 0 0 0 0 0 0
  1538. -1.2785 0.1821 0.0693 C 0 0 0 0 0 0 0 0 0 0 0 0
  1539. -0.9129 -1.0408 -0.4705 C 0 0 0 0 0 0 0 0 0 0 0 0
  1540. 0.3682 -1.4368 -0.6347 N 0 0 0 0 0 0 0 0 0 0 0 0
  1541. 1.3253 -0.5688 -0.2406 C 0 0 0 0 0 0 0 0 0 0 0 0
  1542. 1.0589 0.6750 0.3094 C 0 0 0 0 0 0 0 0 0 0 0 0
  1543. -0.5180 2.0216 0.8931 H 0 0 0 0 0 0 0 0 0 0 0 0
  1544. -2.3238 0.4479 0.1778 H 0 0 0 0 0 0 0 0 0 0 0 0
  1545. -1.6631 -1.7560 -0.7949 H 0 0 0 0 0 0 0 0 0 0 0 0
  1546. 2.3464 -0.9105 -0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0
  1547. 1.8678 1.3318 0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0
  1548. 1 2 2 0
  1549. 2 3 1 0
  1550. 3 4 2 0
  1551. 4 5 1 0
  1552. 5 6 2 0
  1553. 6 1 1 0
  1554. 1 7 1 0
  1555. 2 8 1 0
  1556. 3 9 1 0
  1557. 5 10 1 0
  1558. 6 11 1 0
  1559. M END
  1560. $$$$
  1561. RDKit 3D
  1562. 11 11 0 0 0 0 0 0 0 0999 V2000
  1563. -0.2702 1.0514 0.4724 C 0 0 0 0 0 0 0 0 0 0 0 0
  1564. -1.2785 0.1817 0.0704 C 0 0 0 0 0 0 0 0 0 0 0 0
  1565. -0.9129 -1.0378 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0
  1566. 0.3682 -1.4328 -0.6437 N 0 0 0 0 0 0 0 0 0 0 0 0
  1567. 1.3253 -0.5673 -0.2441 C 0 0 0 0 0 0 0 0 0 0 0 0
  1568. 1.0589 0.6731 0.3136 C 0 0 0 0 0 0 0 0 0 0 0 0
  1569. -0.5180 2.0160 0.9058 H 0 0 0 0 0 0 0 0 0 0 0 0
  1570. -2.3238 0.4468 0.1807 H 0 0 0 0 0 0 0 0 0 0 0 0
  1571. -1.6631 -1.7510 -0.8059 H 0 0 0 0 0 0 0 0 0 0 0 0
  1572. 2.3464 -0.9081 -0.3888 H 0 0 0 0 0 0 0 0 0 0 0 0
  1573. 1.8678 1.3279 0.6167 H 0 0 0 0 0 0 0 0 0 0 0 0
  1574. 1 2 2 0
  1575. 2 3 1 0
  1576. 3 4 2 0
  1577. 4 5 1 0
  1578. 5 6 2 0
  1579. 6 1 1 0
  1580. 1 7 1 0
  1581. 2 8 1 0
  1582. 3 9 1 0
  1583. 5 10 1 0
  1584. 6 11 1 0
  1585. M END
  1586. $$$$
  1587. RDKit 3D
  1588. 11 11 0 0 0 0 0 0 0 0999 V2000
  1589. -0.2702 1.0484 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0
  1590. -1.2785 0.1812 0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0
  1591. -0.9129 -1.0348 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0
  1592. 0.3682 -1.4287 -0.6527 N 0 0 0 0 0 0 0 0 0 0 0 0
  1593. 1.3253 -0.5657 -0.2477 C 0 0 0 0 0 0 0 0 0 0 0 0
  1594. 1.0589 0.6711 0.3178 C 0 0 0 0 0 0 0 0 0 0 0 0
  1595. -0.5180 2.0102 0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0
  1596. -2.3238 0.4456 0.1835 H 0 0 0 0 0 0 0 0 0 0 0 0
  1597. -1.6631 -1.7459 -0.8169 H 0 0 0 0 0 0 0 0 0 0 0 0
  1598. 2.3464 -0.9056 -0.3945 H 0 0 0 0 0 0 0 0 0 0 0 0
  1599. 1.8678 1.3240 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0
  1600. 1 2 2 0
  1601. 2 3 1 0
  1602. 3 4 2 0
  1603. 4 5 1 0
  1604. 5 6 2 0
  1605. 6 1 1 0
  1606. 1 7 1 0
  1607. 2 8 1 0
  1608. 3 9 1 0
  1609. 5 10 1 0
  1610. 6 11 1 0
  1611. M END
  1612. $$$$
  1613. RDKit 3D
  1614. 11 11 0 0 0 0 0 0 0 0999 V2000
  1615. -0.2702 1.0454 0.4856 C 0 0 0 0 0 0 0 0 0 0 0 0
  1616. -1.2785 0.1808 0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0
  1617. -0.9129 -1.0317 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0
  1618. 0.3682 -1.4246 -0.6617 N 0 0 0 0 0 0 0 0 0 0 0 0
  1619. 1.3253 -0.5641 -0.2513 C 0 0 0 0 0 0 0 0 0 0 0 0
  1620. 1.0589 0.6691 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0
  1621. -0.5180 2.0044 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0
  1622. -2.3238 0.4445 0.1863 H 0 0 0 0 0 0 0 0 0 0 0 0
  1623. -1.6631 -1.7407 -0.8279 H 0 0 0 0 0 0 0 0 0 0 0 0
  1624. 2.3464 -0.9031 -0.4002 H 0 0 0 0 0 0 0 0 0 0 0 0
  1625. 1.8678 1.3201 0.6334 H 0 0 0 0 0 0 0 0 0 0 0 0
  1626. 1 2 2 0
  1627. 2 3 1 0
  1628. 3 4 2 0
  1629. 4 5 1 0
  1630. 5 6 2 0
  1631. 6 1 1 0
  1632. 1 7 1 0
  1633. 2 8 1 0
  1634. 3 9 1 0
  1635. 5 10 1 0
  1636. 6 11 1 0
  1637. M END
  1638. $$$$
  1639. RDKit 3D
  1640. 11 11 0 0 0 0 0 0 0 0999 V2000
  1641. -0.2702 1.0423 0.4921 C 0 0 0 0 0 0 0 0 0 0 0 0
  1642. -1.2785 0.1803 0.0738 C 0 0 0 0 0 0 0 0 0 0 0 0
  1643. -0.9129 -1.0286 -0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0
  1644. 0.3682 -1.4204 -0.6706 N 0 0 0 0 0 0 0 0 0 0 0 0
  1645. 1.3253 -0.5625 -0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0
  1646. 1.0589 0.6670 0.3262 C 0 0 0 0 0 0 0 0 0 0 0 0
  1647. -0.5180 1.9985 0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0
  1648. -2.3238 0.4433 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1649. -1.6631 -1.7355 -0.8388 H 0 0 0 0 0 0 0 0 0 0 0 0
  1650. 2.3464 -0.9006 -0.4058 H 0 0 0 0 0 0 0 0 0 0 0 0
  1651. 1.8678 1.3161 0.6416 H 0 0 0 0 0 0 0 0 0 0 0 0
  1652. 1 2 2 0
  1653. 2 3 1 0
  1654. 3 4 2 0
  1655. 4 5 1 0
  1656. 5 6 2 0
  1657. 6 1 1 0
  1658. 1 7 1 0
  1659. 2 8 1 0
  1660. 3 9 1 0
  1661. 5 10 1 0
  1662. 6 11 1 0
  1663. M END
  1664. $$$$
  1665. RDKit 3D
  1666. 11 11 0 0 0 0 0 0 0 0999 V2000
  1667. -0.2702 1.0392 0.4987 C 0 0 0 0 0 0 0 0 0 0 0 0
  1668. -1.2785 0.1798 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  1669. -0.9129 -1.0255 -0.5029 C 0 0 0 0 0 0 0 0 0 0 0 0
  1670. 0.3682 -1.4161 -0.6795 N 0 0 0 0 0 0 0 0 0 0 0 0
  1671. 1.3253 -0.5609 -0.2583 C 0 0 0 0 0 0 0 0 0 0 0 0
  1672. 1.0589 0.6650 0.3304 C 0 0 0 0 0 0 0 0 0 0 0 0
  1673. -0.5180 1.9926 0.9561 H 0 0 0 0 0 0 0 0 0 0 0 0
  1674. -2.3238 0.4421 0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0
  1675. -1.6631 -1.7302 -0.8497 H 0 0 0 0 0 0 0 0 0 0 0 0
  1676. 2.3464 -0.8980 -0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0
  1677. 1.8678 1.3120 0.6499 H 0 0 0 0 0 0 0 0 0 0 0 0
  1678. 1 2 2 0
  1679. 2 3 1 0
  1680. 3 4 2 0
  1681. 4 5 1 0
  1682. 5 6 2 0
  1683. 6 1 1 0
  1684. 1 7 1 0
  1685. 2 8 1 0
  1686. 3 9 1 0
  1687. 5 10 1 0
  1688. 6 11 1 0
  1689. M END
  1690. $$$$
  1691. RDKit 3D
  1692. 11 11 0 0 0 0 0 0 0 0999 V2000
  1693. -0.2702 1.0360 0.5052 C 0 0 0 0 0 0 0 0 0 0 0 0
  1694. -1.2785 0.1794 0.0761 C 0 0 0 0 0 0 0 0 0 0 0 0
  1695. -0.9129 -1.0223 -0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0
  1696. 0.3682 -1.4118 -0.6884 N 0 0 0 0 0 0 0 0 0 0 0 0
  1697. 1.3253 -0.5593 -0.2618 C 0 0 0 0 0 0 0 0 0 0 0 0
  1698. 1.0589 0.6629 0.3346 C 0 0 0 0 0 0 0 0 0 0 0 0
  1699. -0.5180 1.9865 0.9686 H 0 0 0 0 0 0 0 0 0 0 0 0
  1700. -2.3238 0.4409 0.1946 H 0 0 0 0 0 0 0 0 0 0 0 0
  1701. -1.6631 -1.7248 -0.8605 H 0 0 0 0 0 0 0 0 0 0 0 0
  1702. 2.3464 -0.8954 -0.4171 H 0 0 0 0 0 0 0 0 0 0 0 0
  1703. 1.8678 1.3079 0.6581 H 0 0 0 0 0 0 0 0 0 0 0 0
  1704. 1 2 2 0
  1705. 2 3 1 0
  1706. 3 4 2 0
  1707. 4 5 1 0
  1708. 5 6 2 0
  1709. 6 1 1 0
  1710. 1 7 1 0
  1711. 2 8 1 0
  1712. 3 9 1 0
  1713. 5 10 1 0
  1714. 6 11 1 0
  1715. M END
  1716. $$$$
  1717. RDKit 3D
  1718. 11 11 0 0 0 0 0 0 0 0999 V2000
  1719. -0.2702 1.0328 0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0
  1720. -1.2785 0.1789 0.0772 C 0 0 0 0 0 0 0 0 0 0 0 0
  1721. -0.9129 -1.0191 -0.5158 C 0 0 0 0 0 0 0 0 0 0 0 0
  1722. 0.3682 -1.4075 -0.6973 N 0 0 0 0 0 0 0 0 0 0 0 0
  1723. 1.3253 -0.5576 -0.2654 C 0 0 0 0 0 0 0 0 0 0 0 0
  1724. 1.0589 0.6608 0.3387 C 0 0 0 0 0 0 0 0 0 0 0 0
  1725. -0.5180 1.9804 0.9811 H 0 0 0 0 0 0 0 0 0 0 0 0
  1726. -2.3238 0.4396 0.1974 H 0 0 0 0 0 0 0 0 0 0 0 0
  1727. -1.6631 -1.7194 -0.8713 H 0 0 0 0 0 0 0 0 0 0 0 0
  1728. 2.3464 -0.8928 -0.4227 H 0 0 0 0 0 0 0 0 0 0 0 0
  1729. 1.8678 1.3038 0.6663 H 0 0 0 0 0 0 0 0 0 0 0 0
  1730. 1 2 2 0
  1731. 2 3 1 0
  1732. 3 4 2 0
  1733. 4 5 1 0
  1734. 5 6 2 0
  1735. 6 1 1 0
  1736. 1 7 1 0
  1737. 2 8 1 0
  1738. 3 9 1 0
  1739. 5 10 1 0
  1740. 6 11 1 0
  1741. M END
  1742. $$$$
  1743. RDKit 3D
  1744. 11 11 0 0 0 0 0 0 0 0999 V2000
  1745. -0.2702 1.0296 0.5182 C 0 0 0 0 0 0 0 0 0 0 0 0
  1746. -1.2785 0.1784 0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
  1747. -0.9129 -1.0158 -0.5222 C 0 0 0 0 0 0 0 0 0 0 0 0
  1748. 0.3682 -1.4031 -0.7061 N 0 0 0 0 0 0 0 0 0 0 0 0
  1749. 1.3253 -0.5560 -0.2688 C 0 0 0 0 0 0 0 0 0 0 0 0
  1750. 1.0589 0.6586 0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0
  1751. -0.5180 1.9742 0.9935 H 0 0 0 0 0 0 0 0 0 0 0 0
  1752. -2.3238 0.4384 0.2001 H 0 0 0 0 0 0 0 0 0 0 0 0
  1753. -1.6631 -1.7138 -0.8821 H 0 0 0 0 0 0 0 0 0 0 0 0
  1754. 2.3464 -0.8901 -0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0
  1755. 1.8678 1.2995 0.6745 H 0 0 0 0 0 0 0 0 0 0 0 0
  1756. 1 2 2 0
  1757. 2 3 1 0
  1758. 3 4 2 0
  1759. 4 5 1 0
  1760. 5 6 2 0
  1761. 6 1 1 0
  1762. 1 7 1 0
  1763. 2 8 1 0
  1764. 3 9 1 0
  1765. 5 10 1 0
  1766. 6 11 1 0
  1767. M END
  1768. $$$$
  1769. RDKit 3D
  1770. 11 11 0 0 0 0 0 0 0 0999 V2000
  1771. -0.2702 1.0263 0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0
  1772. -1.2785 0.1779 0.0795 C 0 0 0 0 0 0 0 0 0 0 0 0
  1773. -0.9129 -1.0125 -0.5285 C 0 0 0 0 0 0 0 0 0 0 0 0
  1774. 0.3682 -1.3986 -0.7149 N 0 0 0 0 0 0 0 0 0 0 0 0
  1775. 1.3253 -0.5543 -0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0
  1776. 1.0589 0.6565 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0
  1777. -0.5180 1.9679 1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0
  1778. -2.3238 0.4371 0.2029 H 0 0 0 0 0 0 0 0 0 0 0 0
  1779. -1.6631 -1.7083 -0.8929 H 0 0 0 0 0 0 0 0 0 0 0 0
  1780. 2.3464 -0.8874 -0.4339 H 0 0 0 0 0 0 0 0 0 0 0 0
  1781. 1.8678 1.2953 0.6827 H 0 0 0 0 0 0 0 0 0 0 0 0
  1782. 1 2 2 0
  1783. 2 3 1 0
  1784. 3 4 2 0
  1785. 4 5 1 0
  1786. 5 6 2 0
  1787. 6 1 1 0
  1788. 1 7 1 0
  1789. 2 8 1 0
  1790. 3 9 1 0
  1791. 5 10 1 0
  1792. 6 11 1 0
  1793. M END
  1794. $$$$
  1795. RDKit 3D
  1796. 11 11 0 0 0 0 0 0 0 0999 V2000
  1797. -0.2702 1.0230 0.5311 C 0 0 0 0 0 0 0 0 0 0 0 0
  1798. -1.2785 0.1774 0.0806 C 0 0 0 0 0 0 0 0 0 0 0 0
  1799. -0.9129 -1.0092 -0.5349 C 0 0 0 0 0 0 0 0 0 0 0 0
  1800. 0.3682 -1.3941 -0.7237 N 0 0 0 0 0 0 0 0 0 0 0 0
  1801. 1.3253 -0.5525 -0.2758 C 0 0 0 0 0 0 0 0 0 0 0 0
  1802. 1.0589 0.6543 0.3511 C 0 0 0 0 0 0 0 0 0 0 0 0
  1803. -0.5180 1.9616 1.0183 H 0 0 0 0 0 0 0 0 0 0 0 0
  1804. -2.3238 0.4358 0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0
  1805. -1.6631 -1.7026 -0.9036 H 0 0 0 0 0 0 0 0 0 0 0 0
  1806. 2.3464 -0.8846 -0.4395 H 0 0 0 0 0 0 0 0 0 0 0 0
  1807. 1.8678 1.2910 0.6908 H 0 0 0 0 0 0 0 0 0 0 0 0
  1808. 1 2 2 0
  1809. 2 3 1 0
  1810. 3 4 2 0
  1811. 4 5 1 0
  1812. 5 6 2 0
  1813. 6 1 1 0
  1814. 1 7 1 0
  1815. 2 8 1 0
  1816. 3 9 1 0
  1817. 5 10 1 0
  1818. 6 11 1 0
  1819. M END
  1820. $$$$
  1821. RDKit 3D
  1822. 11 11 0 0 0 0 0 0 0 0999 V2000
  1823. -0.2702 1.0197 0.5375 C 0 0 0 0 0 0 0 0 0 0 0 0
  1824. -1.2785 0.1769 0.0817 C 0 0 0 0 0 0 0 0 0 0 0 0
  1825. -0.9129 -1.0058 -0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0
  1826. 0.3682 -1.3895 -0.7324 N 0 0 0 0 0 0 0 0 0 0 0 0
  1827. 1.3253 -0.5508 -0.2793 C 0 0 0 0 0 0 0 0 0 0 0 0
  1828. 1.0589 0.6521 0.3552 C 0 0 0 0 0 0 0 0 0 0 0 0
  1829. -0.5180 1.9551 1.0306 H 0 0 0 0 0 0 0 0 0 0 0 0
  1830. -2.3238 0.4345 0.2084 H 0 0 0 0 0 0 0 0 0 0 0 0
  1831. -1.6631 -1.6969 -0.9143 H 0 0 0 0 0 0 0 0 0 0 0 0
  1832. 2.3464 -0.8819 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  1833. 1.8678 1.2866 0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
  1834. 1 2 2 0
  1835. 2 3 1 0
  1836. 3 4 2 0
  1837. 4 5 1 0
  1838. 5 6 2 0
  1839. 6 1 1 0
  1840. 1 7 1 0
  1841. 2 8 1 0
  1842. 3 9 1 0
  1843. 5 10 1 0
  1844. 6 11 1 0
  1845. M END
  1846. $$$$
  1847. RDKit 3D
  1848. 11 11 0 0 0 0 0 0 0 0999 V2000
  1849. -0.2702 1.0163 0.5439 C 0 0 0 0 0 0 0 0 0 0 0 0
  1850. -1.2785 0.1764 0.0828 C 0 0 0 0 0 0 0 0 0 0 0 0
  1851. -0.9129 -1.0024 -0.5475 C 0 0 0 0 0 0 0 0 0 0 0 0
  1852. 0.3682 -1.3849 -0.7411 N 0 0 0 0 0 0 0 0 0 0 0 0
  1853. 1.3253 -0.5490 -0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0
  1854. 1.0589 0.6498 0.3593 C 0 0 0 0 0 0 0 0 0 0 0 0
  1855. -0.5180 1.9486 1.0428 H 0 0 0 0 0 0 0 0 0 0 0 0
  1856. -2.3238 0.4332 0.2111 H 0 0 0 0 0 0 0 0 0 0 0 0
  1857. -1.6631 -1.6911 -0.9249 H 0 0 0 0 0 0 0 0 0 0 0 0
  1858. 2.3464 -0.8790 -0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0
  1859. 1.8678 1.2822 0.7069 H 0 0 0 0 0 0 0 0 0 0 0 0
  1860. 1 2 2 0
  1861. 2 3 1 0
  1862. 3 4 2 0
  1863. 4 5 1 0
  1864. 5 6 2 0
  1865. 6 1 1 0
  1866. 1 7 1 0
  1867. 2 8 1 0
  1868. 3 9 1 0
  1869. 5 10 1 0
  1870. 6 11 1 0
  1871. M END
  1872. $$$$
  1873. RDKit 3D
  1874. 11 11 0 0 0 0 0 0 0 0999 V2000
  1875. -0.2702 1.0128 0.5502 C 0 0 0 0 0 0 0 0 0 0 0 0
  1876. -1.2785 0.1759 0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0
  1877. -0.9129 -0.9989 -0.5538 C 0 0 0 0 0 0 0 0 0 0 0 0
  1878. 0.3682 -1.3802 -0.7498 N 0 0 0 0 0 0 0 0 0 0 0 0
  1879. 1.3253 -0.5472 -0.2862 C 0 0 0 0 0 0 0 0 0 0 0 0
  1880. 1.0589 0.6475 0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0
  1881. -0.5180 1.9420 1.0551 H 0 0 0 0 0 0 0 0 0 0 0 0
  1882. -2.3238 0.4319 0.2138 H 0 0 0 0 0 0 0 0 0 0 0 0
  1883. -1.6631 -1.6853 -0.9355 H 0 0 0 0 0 0 0 0 0 0 0 0
  1884. 2.3464 -0.8762 -0.4561 H 0 0 0 0 0 0 0 0 0 0 0 0
  1885. 1.8678 1.2777 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0
  1886. 1 2 2 0
  1887. 2 3 1 0
  1888. 3 4 2 0
  1889. 4 5 1 0
  1890. 5 6 2 0
  1891. 6 1 1 0
  1892. 1 7 1 0
  1893. 2 8 1 0
  1894. 3 9 1 0
  1895. 5 10 1 0
  1896. 6 11 1 0
  1897. M END
  1898. $$$$
  1899. RDKit 3D
  1900. 11 11 0 0 0 0 0 0 0 0999 V2000
  1901. -0.2702 1.0093 0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0
  1902. -1.2785 0.1753 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  1903. -0.9129 -0.9954 -0.5601 C 0 0 0 0 0 0 0 0 0 0 0 0
  1904. 0.3682 -1.3755 -0.7585 N 0 0 0 0 0 0 0 0 0 0 0 0
  1905. 1.3253 -0.5454 -0.2896 C 0 0 0 0 0 0 0 0 0 0 0 0
  1906. 1.0589 0.6452 0.3675 C 0 0 0 0 0 0 0 0 0 0 0 0
  1907. -0.5180 1.9353 1.0672 H 0 0 0 0 0 0 0 0 0 0 0 0
  1908. -2.3238 0.4305 0.2165 H 0 0 0 0 0 0 0 0 0 0 0 0
  1909. -1.6631 -1.6794 -0.9461 H 0 0 0 0 0 0 0 0 0 0 0 0
  1910. 2.3464 -0.8733 -0.4616 H 0 0 0 0 0 0 0 0 0 0 0 0
  1911. 1.8678 1.2732 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0
  1912. 1 2 2 0
  1913. 2 3 1 0
  1914. 3 4 2 0
  1915. 4 5 1 0
  1916. 5 6 2 0
  1917. 6 1 1 0
  1918. 1 7 1 0
  1919. 2 8 1 0
  1920. 3 9 1 0
  1921. 5 10 1 0
  1922. 6 11 1 0
  1923. M END
  1924. $$$$
  1925. RDKit 3D
  1926. 11 11 0 0 0 0 0 0 0 0999 V2000
  1927. -0.2702 1.0058 0.5629 C 0 0 0 0 0 0 0 0 0 0 0 0
  1928. -1.2785 0.1748 0.0861 C 0 0 0 0 0 0 0 0 0 0 0 0
  1929. -0.9129 -0.9919 -0.5663 C 0 0 0 0 0 0 0 0 0 0 0 0
  1930. 0.3682 -1.3707 -0.7671 N 0 0 0 0 0 0 0 0 0 0 0 0
  1931. 1.3253 -0.5436 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0
  1932. 1.0589 0.6429 0.3715 C 0 0 0 0 0 0 0 0 0 0 0 0
  1933. -0.5180 1.9286 1.0794 H 0 0 0 0 0 0 0 0 0 0 0 0
  1934. -2.3238 0.4292 0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0
  1935. -1.6631 -1.6734 -0.9566 H 0 0 0 0 0 0 0 0 0 0 0 0
  1936. 2.3464 -0.8704 -0.4671 H 0 0 0 0 0 0 0 0 0 0 0 0
  1937. 1.8678 1.2686 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0
  1938. 1 2 2 0
  1939. 2 3 1 0
  1940. 3 4 2 0
  1941. 4 5 1 0
  1942. 5 6 2 0
  1943. 6 1 1 0
  1944. 1 7 1 0
  1945. 2 8 1 0
  1946. 3 9 1 0
  1947. 5 10 1 0
  1948. 6 11 1 0
  1949. M END
  1950. $$$$
  1951. RDKit 3D
  1952. 11 11 0 0 0 0 0 0 0 0999 V2000
  1953. -0.2702 1.0023 0.5692 C 0 0 0 0 0 0 0 0 0 0 0 0
  1954. -1.2785 0.1742 0.0872 C 0 0 0 0 0 0 0 0 0 0 0 0
  1955. -0.9129 -0.9883 -0.5725 C 0 0 0 0 0 0 0 0 0 0 0 0
  1956. 0.3682 -1.3658 -0.7757 N 0 0 0 0 0 0 0 0 0 0 0 0
  1957. 1.3253 -0.5418 -0.2964 C 0 0 0 0 0 0 0 0 0 0 0 0
  1958. 1.0589 0.6406 0.3756 C 0 0 0 0 0 0 0 0 0 0 0 0
  1959. -0.5180 1.9218 1.0915 H 0 0 0 0 0 0 0 0 0 0 0 0
  1960. -2.3238 0.4278 0.2219 H 0 0 0 0 0 0 0 0 0 0 0 0
  1961. -1.6631 -1.6674 -0.9671 H 0 0 0 0 0 0 0 0 0 0 0 0
  1962. 2.3464 -0.8674 -0.4725 H 0 0 0 0 0 0 0 0 0 0 0 0
  1963. 1.8678 1.2640 0.7389 H 0 0 0 0 0 0 0 0 0 0 0 0
  1964. 1 2 2 0
  1965. 2 3 1 0
  1966. 3 4 2 0
  1967. 4 5 1 0
  1968. 5 6 2 0
  1969. 6 1 1 0
  1970. 1 7 1 0
  1971. 2 8 1 0
  1972. 3 9 1 0
  1973. 5 10 1 0
  1974. 6 11 1 0
  1975. M END
  1976. $$$$
  1977. RDKit 3D
  1978. 11 11 0 0 0 0 0 0 0 0999 V2000
  1979. -0.2702 0.9987 0.5755 C 0 0 0 0 0 0 0 0 0 0 0 0
  1980. -1.2785 0.1737 0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0
  1981. -0.9129 -0.9847 -0.5787 C 0 0 0 0 0 0 0 0 0 0 0 0
  1982. 0.3682 -1.3609 -0.7843 N 0 0 0 0 0 0 0 0 0 0 0 0
  1983. 1.3253 -0.5399 -0.2998 C 0 0 0 0 0 0 0 0 0 0 0 0
  1984. 1.0589 0.6382 0.3796 C 0 0 0 0 0 0 0 0 0 0 0 0
  1985. -0.5180 1.9149 1.1035 H 0 0 0 0 0 0 0 0 0 0 0 0
  1986. -2.3238 0.4264 0.2246 H 0 0 0 0 0 0 0 0 0 0 0 0
  1987. -1.6631 -1.6613 -0.9776 H 0 0 0 0 0 0 0 0 0 0 0 0
  1988. 2.3464 -0.8645 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
  1989. 1.8678 1.2593 0.7469 H 0 0 0 0 0 0 0 0 0 0 0 0
  1990. 1 2 2 0
  1991. 2 3 1 0
  1992. 3 4 2 0
  1993. 4 5 1 0
  1994. 5 6 2 0
  1995. 6 1 1 0
  1996. 1 7 1 0
  1997. 2 8 1 0
  1998. 3 9 1 0
  1999. 5 10 1 0
  2000. 6 11 1 0
  2001. M END
  2002. $$$$
  2003. RDKit 3D
  2004. 11 11 0 0 0 0 0 0 0 0999 V2000
  2005. -0.2702 0.9950 0.5818 C 0 0 0 0 0 0 0 0 0 0 0 0
  2006. -1.2785 0.1731 0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0
  2007. -0.9129 -0.9810 -0.5849 C 0 0 0 0 0 0 0 0 0 0 0 0
  2008. 0.3682 -1.3560 -0.7928 N 0 0 0 0 0 0 0 0 0 0 0 0
  2009. 1.3253 -0.5380 -0.3032 C 0 0 0 0 0 0 0 0 0 0 0 0
  2010. 1.0589 0.6358 0.3836 C 0 0 0 0 0 0 0 0 0 0 0 0
  2011. -0.5180 1.9079 1.1155 H 0 0 0 0 0 0 0 0 0 0 0 0
  2012. -2.3238 0.4250 0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0
  2013. -1.6631 -1.6551 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0
  2014. 2.3464 -0.8614 -0.4834 H 0 0 0 0 0 0 0 0 0 0 0 0
  2015. 1.8678 1.2546 0.7548 H 0 0 0 0 0 0 0 0 0 0 0 0
  2016. 1 2 2 0
  2017. 2 3 1 0
  2018. 3 4 2 0
  2019. 4 5 1 0
  2020. 5 6 2 0
  2021. 6 1 1 0
  2022. 1 7 1 0
  2023. 2 8 1 0
  2024. 3 9 1 0
  2025. 5 10 1 0
  2026. 6 11 1 0
  2027. M END
  2028. $$$$
  2029. RDKit 3D
  2030. 11 11 0 0 0 0 0 0 0 0999 V2000
  2031. -0.2702 0.9914 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0
  2032. -1.2785 0.1726 0.0905 C 0 0 0 0 0 0 0 0 0 0 0 0
  2033. -0.9129 -0.9773 -0.5911 C 0 0 0 0 0 0 0 0 0 0 0 0
  2034. 0.3682 -1.3510 -0.8013 N 0 0 0 0 0 0 0 0 0 0 0 0
  2035. 1.3253 -0.5361 -0.3066 C 0 0 0 0 0 0 0 0 0 0 0 0
  2036. 1.0589 0.6334 0.3876 C 0 0 0 0 0 0 0 0 0 0 0 0
  2037. -0.5180 1.9009 1.1275 H 0 0 0 0 0 0 0 0 0 0 0 0
  2038. -2.3238 0.4235 0.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
  2039. -1.6631 -1.6488 -0.9984 H 0 0 0 0 0 0 0 0 0 0 0 0
  2040. 2.3464 -0.8584 -0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0
  2041. 1.8678 1.2499 0.7626 H 0 0 0 0 0 0 0 0 0 0 0 0
  2042. 1 2 2 0
  2043. 2 3 1 0
  2044. 3 4 2 0
  2045. 4 5 1 0
  2046. 5 6 2 0
  2047. 6 1 1 0
  2048. 1 7 1 0
  2049. 2 8 1 0
  2050. 3 9 1 0
  2051. 5 10 1 0
  2052. 6 11 1 0
  2053. M END
  2054. $$$$
  2055. RDKit 3D
  2056. 11 11 0 0 0 0 0 0 0 0999 V2000
  2057. -0.2702 0.9876 0.5942 C 0 0 0 0 0 0 0 0 0 0 0 0
  2058. -1.2785 0.1720 0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
  2059. -0.9129 -0.9736 -0.5972 C 0 0 0 0 0 0 0 0 0 0 0 0
  2060. 0.3682 -1.3459 -0.8098 N 0 0 0 0 0 0 0 0 0 0 0 0
  2061. 1.3253 -0.5341 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0
  2062. 1.0589 0.6309 0.3915 C 0 0 0 0 0 0 0 0 0 0 0 0
  2063. -0.5180 1.8938 1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0
  2064. -2.3238 0.4221 0.2326 H 0 0 0 0 0 0 0 0 0 0 0 0
  2065. -1.6631 -1.6425 -1.0087 H 0 0 0 0 0 0 0 0 0 0 0 0
  2066. 2.3464 -0.8553 -0.4942 H 0 0 0 0 0 0 0 0 0 0 0 0
  2067. 1.8678 1.2450 0.7705 H 0 0 0 0 0 0 0 0 0 0 0 0
  2068. 1 2 2 0
  2069. 2 3 1 0
  2070. 3 4 2 0
  2071. 4 5 1 0
  2072. 5 6 2 0
  2073. 6 1 1 0
  2074. 1 7 1 0
  2075. 2 8 1 0
  2076. 3 9 1 0
  2077. 5 10 1 0
  2078. 6 11 1 0
  2079. M END
  2080. $$$$
  2081. RDKit 3D
  2082. 11 11 0 0 0 0 0 0 0 0999 V2000
  2083. -0.2702 0.9839 0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0
  2084. -1.2785 0.1714 0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0
  2085. -0.9129 -0.9698 -0.6033 C 0 0 0 0 0 0 0 0 0 0 0 0
  2086. 0.3682 -1.3408 -0.8182 N 0 0 0 0 0 0 0 0 0 0 0 0
  2087. 1.3253 -0.5322 -0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0
  2088. 1.0589 0.6285 0.3955 C 0 0 0 0 0 0 0 0 0 0 0 0
  2089. -0.5180 1.8866 1.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
  2090. -2.3238 0.4206 0.2352 H 0 0 0 0 0 0 0 0 0 0 0 0
  2091. -1.6631 -1.6362 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0
  2092. 2.3464 -0.8522 -0.4995 H 0 0 0 0 0 0 0 0 0 0 0 0
  2093. 1.8678 1.2402 0.7783 H 0 0 0 0 0 0 0 0 0 0 0 0
  2094. 1 2 2 0
  2095. 2 3 1 0
  2096. 3 4 2 0
  2097. 4 5 1 0
  2098. 5 6 2 0
  2099. 6 1 1 0
  2100. 1 7 1 0
  2101. 2 8 1 0
  2102. 3 9 1 0
  2103. 5 10 1 0
  2104. 6 11 1 0
  2105. M END
  2106. $$$$
  2107. RDKit 3D
  2108. 11 11 0 0 0 0 0 0 0 0999 V2000
  2109. -0.2702 0.9801 0.6066 C 0 0 0 0 0 0 0 0 0 0 0 0
  2110. -1.2785 0.1708 0.0937 C 0 0 0 0 0 0 0 0 0 0 0 0
  2111. -0.9129 -0.9660 -0.6094 C 0 0 0 0 0 0 0 0 0 0 0 0
  2112. 0.3682 -1.3356 -0.8266 N 0 0 0 0 0 0 0 0 0 0 0 0
  2113. 1.3253 -0.5302 -0.3167 C 0 0 0 0 0 0 0 0 0 0 0 0
  2114. 1.0589 0.6260 0.3994 C 0 0 0 0 0 0 0 0 0 0 0 0
  2115. -0.5180 1.8793 1.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
  2116. -2.3238 0.4191 0.2379 H 0 0 0 0 0 0 0 0 0 0 0 0
  2117. -1.6631 -1.6297 -1.0293 H 0 0 0 0 0 0 0 0 0 0 0 0
  2118. 2.3464 -0.8490 -0.5049 H 0 0 0 0 0 0 0 0 0 0 0 0
  2119. 1.8678 1.2353 0.7861 H 0 0 0 0 0 0 0 0 0 0 0 0
  2120. 1 2 2 0
  2121. 2 3 1 0
  2122. 3 4 2 0
  2123. 4 5 1 0
  2124. 5 6 2 0
  2125. 6 1 1 0
  2126. 1 7 1 0
  2127. 2 8 1 0
  2128. 3 9 1 0
  2129. 5 10 1 0
  2130. 6 11 1 0
  2131. M END
  2132. $$$$
  2133. RDKit 3D
  2134. 11 11 0 0 0 0 0 0 0 0999 V2000
  2135. -0.2702 0.9763 0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0
  2136. -1.2785 0.1702 0.0948 C 0 0 0 0 0 0 0 0 0 0 0 0
  2137. -0.9129 -0.9622 -0.6154 C 0 0 0 0 0 0 0 0 0 0 0 0
  2138. 0.3682 -1.3304 -0.8350 N 0 0 0 0 0 0 0 0 0 0 0 0
  2139. 1.3253 -0.5282 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0
  2140. 1.0589 0.6234 0.4034 C 0 0 0 0 0 0 0 0 0 0 0 0
  2141. -0.5180 1.8719 1.1749 H 0 0 0 0 0 0 0 0 0 0 0 0
  2142. -2.3238 0.4176 0.2405 H 0 0 0 0 0 0 0 0 0 0 0 0
  2143. -1.6631 -1.6232 -1.0395 H 0 0 0 0 0 0 0 0 0 0 0 0
  2144. 2.3464 -0.8458 -0.5102 H 0 0 0 0 0 0 0 0 0 0 0 0
  2145. 1.8678 1.2303 0.7938 H 0 0 0 0 0 0 0 0 0 0 0 0
  2146. 1 2 2 0
  2147. 2 3 1 0
  2148. 3 4 2 0
  2149. 4 5 1 0
  2150. 5 6 2 0
  2151. 6 1 1 0
  2152. 1 7 1 0
  2153. 2 8 1 0
  2154. 3 9 1 0
  2155. 5 10 1 0
  2156. 6 11 1 0
  2157. M END
  2158. $$$$
  2159. RDKit 3D
  2160. 11 11 0 0 0 0 0 0 0 0999 V2000
  2161. -0.2702 0.9724 0.6189 C 0 0 0 0 0 0 0 0 0 0 0 0
  2162. -1.2785 0.1696 0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
  2163. -0.9129 -0.9583 -0.6215 C 0 0 0 0 0 0 0 0 0 0 0 0
  2164. 0.3682 -1.3251 -0.8434 N 0 0 0 0 0 0 0 0 0 0 0 0
  2165. 1.3253 -0.5262 -0.3233 C 0 0 0 0 0 0 0 0 0 0 0 0
  2166. 1.0589 0.6209 0.4073 C 0 0 0 0 0 0 0 0 0 0 0 0
  2167. -0.5180 1.8645 1.1867 H 0 0 0 0 0 0 0 0 0 0 0 0
  2168. -2.3238 0.4161 0.2431 H 0 0 0 0 0 0 0 0 0 0 0 0
  2169. -1.6631 -1.6167 -1.0497 H 0 0 0 0 0 0 0 0 0 0 0 0
  2170. 2.3464 -0.8426 -0.5155 H 0 0 0 0 0 0 0 0 0 0 0 0
  2171. 1.8678 1.2253 0.8015 H 0 0 0 0 0 0 0 0 0 0 0 0
  2172. 1 2 2 0
  2173. 2 3 1 0
  2174. 3 4 2 0
  2175. 4 5 1 0
  2176. 5 6 2 0
  2177. 6 1 1 0
  2178. 1 7 1 0
  2179. 2 8 1 0
  2180. 3 9 1 0
  2181. 5 10 1 0
  2182. 6 11 1 0
  2183. M END
  2184. $$$$
  2185. RDKit 3D
  2186. 11 11 0 0 0 0 0 0 0 0999 V2000
  2187. -0.2702 0.9685 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0
  2188. -1.2785 0.1690 0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0
  2189. -0.9129 -0.9543 -0.6275 C 0 0 0 0 0 0 0 0 0 0 0 0
  2190. 0.3682 -1.3198 -0.8517 N 0 0 0 0 0 0 0 0 0 0 0 0
  2191. 1.3253 -0.5241 -0.3266 C 0 0 0 0 0 0 0 0 0 0 0 0
  2192. 1.0589 0.6183 0.4112 C 0 0 0 0 0 0 0 0 0 0 0 0
  2193. -0.5180 1.8570 1.1983 H 0 0 0 0 0 0 0 0 0 0 0 0
  2194. -2.3238 0.4145 0.2457 H 0 0 0 0 0 0 0 0 0 0 0 0
  2195. -1.6631 -1.6100 -1.0598 H 0 0 0 0 0 0 0 0 0 0 0 0
  2196. 2.3464 -0.8393 -0.5208 H 0 0 0 0 0 0 0 0 0 0 0 0
  2197. 1.8678 1.2202 0.8092 H 0 0 0 0 0 0 0 0 0 0 0 0
  2198. 1 2 2 0
  2199. 2 3 1 0
  2200. 3 4 2 0
  2201. 4 5 1 0
  2202. 5 6 2 0
  2203. 6 1 1 0
  2204. 1 7 1 0
  2205. 2 8 1 0
  2206. 3 9 1 0
  2207. 5 10 1 0
  2208. 6 11 1 0
  2209. M END
  2210. $$$$
  2211. RDKit 3D
  2212. 11 11 0 0 0 0 0 0 0 0999 V2000
  2213. -0.2702 0.9646 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0
  2214. -1.2785 0.1684 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  2215. -0.9129 -0.9504 -0.6335 C 0 0 0 0 0 0 0 0 0 0 0 0
  2216. 0.3682 -1.3144 -0.8599 N 0 0 0 0 0 0 0 0 0 0 0 0
  2217. 1.3253 -0.5221 -0.3299 C 0 0 0 0 0 0 0 0 0 0 0 0
  2218. 1.0589 0.6157 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0
  2219. -0.5180 1.8495 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  2220. -2.3238 0.4130 0.2483 H 0 0 0 0 0 0 0 0 0 0 0 0
  2221. -1.6631 -1.6033 -1.0699 H 0 0 0 0 0 0 0 0 0 0 0 0
  2222. 2.3464 -0.8361 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0
  2223. 1.8678 1.2151 0.8169 H 0 0 0 0 0 0 0 0 0 0 0 0
  2224. 1 2 2 0
  2225. 2 3 1 0
  2226. 3 4 2 0
  2227. 4 5 1 0
  2228. 5 6 2 0
  2229. 6 1 1 0
  2230. 1 7 1 0
  2231. 2 8 1 0
  2232. 3 9 1 0
  2233. 5 10 1 0
  2234. 6 11 1 0
  2235. M END
  2236. $$$$
  2237. RDKit 3D
  2238. 11 11 0 0 0 0 0 0 0 0999 V2000
  2239. -0.2702 0.9606 0.6371 C 0 0 0 0 0 0 0 0 0 0 0 0
  2240. -1.2785 0.1678 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0
  2241. -0.9129 -0.9464 -0.6394 C 0 0 0 0 0 0 0 0 0 0 0 0
  2242. 0.3682 -1.3090 -0.8682 N 0 0 0 0 0 0 0 0 0 0 0 0
  2243. 1.3253 -0.5200 -0.3331 C 0 0 0 0 0 0 0 0 0 0 0 0
  2244. 1.0589 0.6131 0.4189 C 0 0 0 0 0 0 0 0 0 0 0 0
  2245. -0.5180 1.8418 1.2216 H 0 0 0 0 0 0 0 0 0 0 0 0
  2246. -2.3238 0.4114 0.2509 H 0 0 0 0 0 0 0 0 0 0 0 0
  2247. -1.6631 -1.5966 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0
  2248. 2.3464 -0.8327 -0.5313 H 0 0 0 0 0 0 0 0 0 0 0 0
  2249. 1.8678 1.2100 0.8245 H 0 0 0 0 0 0 0 0 0 0 0 0
  2250. 1 2 2 0
  2251. 2 3 1 0
  2252. 3 4 2 0
  2253. 4 5 1 0
  2254. 5 6 2 0
  2255. 6 1 1 0
  2256. 1 7 1 0
  2257. 2 8 1 0
  2258. 3 9 1 0
  2259. 5 10 1 0
  2260. 6 11 1 0
  2261. M END
  2262. $$$$
  2263. RDKit 3D
  2264. 11 11 0 0 0 0 0 0 0 0999 V2000
  2265. -0.2702 0.9565 0.6431 C 0 0 0 0 0 0 0 0 0 0 0 0
  2266. -1.2785 0.1672 0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0
  2267. -0.9129 -0.9424 -0.6454 C 0 0 0 0 0 0 0 0 0 0 0 0
  2268. 0.3682 -1.3035 -0.8764 N 0 0 0 0 0 0 0 0 0 0 0 0
  2269. 1.3253 -0.5179 -0.3364 C 0 0 0 0 0 0 0 0 0 0 0 0
  2270. 1.0589 0.6105 0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0
  2271. -0.5180 1.8341 1.2331 H 0 0 0 0 0 0 0 0 0 0 0 0
  2272. -2.3238 0.4098 0.2535 H 0 0 0 0 0 0 0 0 0 0 0 0
  2273. -1.6631 -1.5898 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0
  2274. 2.3464 -0.8294 -0.5365 H 0 0 0 0 0 0 0 0 0 0 0 0
  2275. 1.8678 1.2048 0.8321 H 0 0 0 0 0 0 0 0 0 0 0 0
  2276. 1 2 2 0
  2277. 2 3 1 0
  2278. 3 4 2 0
  2279. 4 5 1 0
  2280. 5 6 2 0
  2281. 6 1 1 0
  2282. 1 7 1 0
  2283. 2 8 1 0
  2284. 3 9 1 0
  2285. 5 10 1 0
  2286. 6 11 1 0
  2287. M END
  2288. $$$$
  2289. RDKit 3D
  2290. 11 11 0 0 0 0 0 0 0 0999 V2000
  2291. -0.2702 0.9525 0.6491 C 0 0 0 0 0 0 0 0 0 0 0 0
  2292. -1.2785 0.1665 0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
  2293. -0.9129 -0.9383 -0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0
  2294. 0.3682 -1.2980 -0.8846 N 0 0 0 0 0 0 0 0 0 0 0 0
  2295. 1.3253 -0.5158 -0.3397 C 0 0 0 0 0 0 0 0 0 0 0 0
  2296. 1.0589 0.6078 0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0
  2297. -0.5180 1.8263 1.2446 H 0 0 0 0 0 0 0 0 0 0 0 0
  2298. -2.3238 0.4082 0.2561 H 0 0 0 0 0 0 0 0 0 0 0 0
  2299. -1.6631 -1.5829 -1.0999 H 0 0 0 0 0 0 0 0 0 0 0 0
  2300. 2.3464 -0.8260 -0.5417 H 0 0 0 0 0 0 0 0 0 0 0 0
  2301. 1.8678 1.1995 0.8396 H 0 0 0 0 0 0 0 0 0 0 0 0
  2302. 1 2 2 0
  2303. 2 3 1 0
  2304. 3 4 2 0
  2305. 4 5 1 0
  2306. 5 6 2 0
  2307. 6 1 1 0
  2308. 1 7 1 0
  2309. 2 8 1 0
  2310. 3 9 1 0
  2311. 5 10 1 0
  2312. 6 11 1 0
  2313. M END
  2314. $$$$
  2315. RDKit 3D
  2316. 11 11 0 0 0 0 0 0 0 0999 V2000
  2317. -0.2702 0.9484 0.6551 C 0 0 0 0 0 0 0 0 0 0 0 0
  2318. -1.2785 0.1659 0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0
  2319. -0.9129 -0.9342 -0.6571 C 0 0 0 0 0 0 0 0 0 0 0 0
  2320. 0.3682 -1.2924 -0.8927 N 0 0 0 0 0 0 0 0 0 0 0 0
  2321. 1.3253 -0.5136 -0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0
  2322. 1.0589 0.6051 0.4304 C 0 0 0 0 0 0 0 0 0 0 0 0
  2323. -0.5180 1.8185 1.2561 H 0 0 0 0 0 0 0 0 0 0 0 0
  2324. -2.3238 0.4066 0.2586 H 0 0 0 0 0 0 0 0 0 0 0 0
  2325. -1.6631 -1.5760 -1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0
  2326. 2.3464 -0.8226 -0.5469 H 0 0 0 0 0 0 0 0 0 0 0 0
  2327. 1.8678 1.1942 0.8471 H 0 0 0 0 0 0 0 0 0 0 0 0
  2328. 1 2 2 0
  2329. 2 3 1 0
  2330. 3 4 2 0
  2331. 4 5 1 0
  2332. 5 6 2 0
  2333. 6 1 1 0
  2334. 1 7 1 0
  2335. 2 8 1 0
  2336. 3 9 1 0
  2337. 5 10 1 0
  2338. 6 11 1 0
  2339. M END
  2340. $$$$
  2341. RDKit 3D
  2342. 11 11 0 0 0 0 0 0 0 0999 V2000
  2343. -0.2702 0.9443 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0
  2344. -1.2785 0.1653 0.1032 C 0 0 0 0 0 0 0 0 0 0 0 0
  2345. -0.9129 -0.9300 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0
  2346. 0.3682 -1.2868 -0.9008 N 0 0 0 0 0 0 0 0 0 0 0 0
  2347. 1.3253 -0.5115 -0.3461 C 0 0 0 0 0 0 0 0 0 0 0 0
  2348. 1.0589 0.6024 0.4342 C 0 0 0 0 0 0 0 0 0 0 0 0
  2349. -0.5180 1.8105 1.2675 H 0 0 0 0 0 0 0 0 0 0 0 0
  2350. -2.3238 0.4050 0.2612 H 0 0 0 0 0 0 0 0 0 0 0 0
  2351. -1.6631 -1.5689 -1.1197 H 0 0 0 0 0 0 0 0 0 0 0 0
  2352. 2.3464 -0.8191 -0.5521 H 0 0 0 0 0 0 0 0 0 0 0 0
  2353. 1.8678 1.1889 0.8546 H 0 0 0 0 0 0 0 0 0 0 0 0
  2354. 1 2 2 0
  2355. 2 3 1 0
  2356. 3 4 2 0
  2357. 4 5 1 0
  2358. 5 6 2 0
  2359. 6 1 1 0
  2360. 1 7 1 0
  2361. 2 8 1 0
  2362. 3 9 1 0
  2363. 5 10 1 0
  2364. 6 11 1 0
  2365. M END
  2366. $$$$
  2367. RDKit 3D
  2368. 11 11 0 0 0 0 0 0 0 0999 V2000
  2369. -0.2702 0.9401 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0
  2370. -1.2785 0.1646 0.1043 C 0 0 0 0 0 0 0 0 0 0 0 0
  2371. -0.9129 -0.9258 -0.6688 C 0 0 0 0 0 0 0 0 0 0 0 0
  2372. 0.3682 -1.2811 -0.9089 N 0 0 0 0 0 0 0 0 0 0 0 0
  2373. 1.3253 -0.5093 -0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0
  2374. 1.0589 0.5996 0.4379 C 0 0 0 0 0 0 0 0 0 0 0 0
  2375. -0.5180 1.8025 1.2788 H 0 0 0 0 0 0 0 0 0 0 0 0
  2376. -2.3238 0.4033 0.2637 H 0 0 0 0 0 0 0 0 0 0 0 0
  2377. -1.6631 -1.5619 -1.1296 H 0 0 0 0 0 0 0 0 0 0 0 0
  2378. 2.3464 -0.8156 -0.5572 H 0 0 0 0 0 0 0 0 0 0 0 0
  2379. 1.8678 1.1835 0.8621 H 0 0 0 0 0 0 0 0 0 0 0 0
  2380. 1 2 2 0
  2381. 2 3 1 0
  2382. 3 4 2 0
  2383. 4 5 1 0
  2384. 5 6 2 0
  2385. 6 1 1 0
  2386. 1 7 1 0
  2387. 2 8 1 0
  2388. 3 9 1 0
  2389. 5 10 1 0
  2390. 6 11 1 0
  2391. M END
  2392. $$$$
  2393. RDKit 3D
  2394. 11 11 0 0 0 0 0 0 0 0999 V2000
  2395. -0.2702 0.9359 0.6728 C 0 0 0 0 0 0 0 0 0 0 0 0
  2396. -1.2785 0.1640 0.1053 C 0 0 0 0 0 0 0 0 0 0 0 0
  2397. -0.9129 -0.9216 -0.6746 C 0 0 0 0 0 0 0 0 0 0 0 0
  2398. 0.3682 -1.2753 -0.9169 N 0 0 0 0 0 0 0 0 0 0 0 0
  2399. 1.3253 -0.5071 -0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0
  2400. 1.0589 0.5969 0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0
  2401. -0.5180 1.7945 1.2901 H 0 0 0 0 0 0 0 0 0 0 0 0
  2402. -2.3238 0.4017 0.2662 H 0 0 0 0 0 0 0 0 0 0 0 0
  2403. -1.6631 -1.5548 -1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0
  2404. 2.3464 -0.8121 -0.5623 H 0 0 0 0 0 0 0 0 0 0 0 0
  2405. 1.8678 1.1780 0.8695 H 0 0 0 0 0 0 0 0 0 0 0 0
  2406. 1 2 2 0
  2407. 2 3 1 0
  2408. 3 4 2 0
  2409. 4 5 1 0
  2410. 5 6 2 0
  2411. 6 1 1 0
  2412. 1 7 1 0
  2413. 2 8 1 0
  2414. 3 9 1 0
  2415. 5 10 1 0
  2416. 6 11 1 0
  2417. M END
  2418. $$$$
  2419. RDKit 3D
  2420. 11 11 0 0 0 0 0 0 0 0999 V2000
  2421. -0.2702 0.9316 0.6787 C 0 0 0 0 0 0 0 0 0 0 0 0
  2422. -1.2785 0.1633 0.1063 C 0 0 0 0 0 0 0 0 0 0 0 0
  2423. -0.9129 -0.9174 -0.6804 C 0 0 0 0 0 0 0 0 0 0 0 0
  2424. 0.3682 -1.2695 -0.9249 N 0 0 0 0 0 0 0 0 0 0 0 0
  2425. 1.3253 -0.5048 -0.3557 C 0 0 0 0 0 0 0 0 0 0 0 0
  2426. 1.0589 0.5941 0.4454 C 0 0 0 0 0 0 0 0 0 0 0 0
  2427. -0.5180 1.7863 1.3014 H 0 0 0 0 0 0 0 0 0 0 0 0
  2428. -2.3238 0.4000 0.2688 H 0 0 0 0 0 0 0 0 0 0 0 0
  2429. -1.6631 -1.5476 -1.1491 H 0 0 0 0 0 0 0 0 0 0 0 0
  2430. 2.3464 -0.8086 -0.5674 H 0 0 0 0 0 0 0 0 0 0 0 0
  2431. 1.8678 1.1725 0.8769 H 0 0 0 0 0 0 0 0 0 0 0 0
  2432. 1 2 2 0
  2433. 2 3 1 0
  2434. 3 4 2 0
  2435. 4 5 1 0
  2436. 5 6 2 0
  2437. 6 1 1 0
  2438. 1 7 1 0
  2439. 2 8 1 0
  2440. 3 9 1 0
  2441. 5 10 1 0
  2442. 6 11 1 0
  2443. M END
  2444. $$$$
  2445. RDKit 3D
  2446. 11 11 0 0 0 0 0 0 0 0999 V2000
  2447. -0.2702 0.9273 0.6846 C 0 0 0 0 0 0 0 0 0 0 0 0
  2448. -1.2785 0.1626 0.1074 C 0 0 0 0 0 0 0 0 0 0 0 0
  2449. -0.9129 -0.9131 -0.6862 C 0 0 0 0 0 0 0 0 0 0 0 0
  2450. 0.3682 -1.2637 -0.9329 N 0 0 0 0 0 0 0 0 0 0 0 0
  2451. 1.3253 -0.5026 -0.3589 C 0 0 0 0 0 0 0 0 0 0 0 0
  2452. 1.0589 0.5913 0.4492 C 0 0 0 0 0 0 0 0 0 0 0 0
  2453. -0.5180 1.7781 1.3126 H 0 0 0 0 0 0 0 0 0 0 0 0
  2454. -2.3238 0.3983 0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0
  2455. -1.6631 -1.5403 -1.1588 H 0 0 0 0 0 0 0 0 0 0 0 0
  2456. 2.3464 -0.8050 -0.5725 H 0 0 0 0 0 0 0 0 0 0 0 0
  2457. 1.8678 1.1670 0.8842 H 0 0 0 0 0 0 0 0 0 0 0 0
  2458. 1 2 2 0
  2459. 2 3 1 0
  2460. 3 4 2 0
  2461. 4 5 1 0
  2462. 5 6 2 0
  2463. 6 1 1 0
  2464. 1 7 1 0
  2465. 2 8 1 0
  2466. 3 9 1 0
  2467. 5 10 1 0
  2468. 6 11 1 0
  2469. M END
  2470. $$$$
  2471. RDKit 3D
  2472. 11 11 0 0 0 0 0 0 0 0999 V2000
  2473. -0.2702 0.9230 0.6904 C 0 0 0 0 0 0 0 0 0 0 0 0
  2474. -1.2785 0.1619 0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0
  2475. -0.9129 -0.9087 -0.6919 C 0 0 0 0 0 0 0 0 0 0 0 0
  2476. 0.3682 -1.2578 -0.9408 N 0 0 0 0 0 0 0 0 0 0 0 0
  2477. 1.3253 -0.5003 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0
  2478. 1.0589 0.5885 0.4529 C 0 0 0 0 0 0 0 0 0 0 0 0
  2479. -0.5180 1.7698 1.3237 H 0 0 0 0 0 0 0 0 0 0 0 0
  2480. -2.3238 0.3966 0.2738 H 0 0 0 0 0 0 0 0 0 0 0 0
  2481. -1.6631 -1.5330 -1.1685 H 0 0 0 0 0 0 0 0 0 0 0 0
  2482. 2.3464 -0.8014 -0.5775 H 0 0 0 0 0 0 0 0 0 0 0 0
  2483. 1.8678 1.1614 0.8915 H 0 0 0 0 0 0 0 0 0 0 0 0
  2484. 1 2 2 0
  2485. 2 3 1 0
  2486. 3 4 2 0
  2487. 4 5 1 0
  2488. 5 6 2 0
  2489. 6 1 1 0
  2490. 1 7 1 0
  2491. 2 8 1 0
  2492. 3 9 1 0
  2493. 5 10 1 0
  2494. 6 11 1 0
  2495. M END
  2496. $$$$
  2497. RDKit 3D
  2498. 11 11 0 0 0 0 0 0 0 0999 V2000
  2499. -0.2702 0.9187 0.6962 C 0 0 0 0 0 0 0 0 0 0 0 0
  2500. -1.2785 0.1613 0.1094 C 0 0 0 0 0 0 0 0 0 0 0 0
  2501. -0.9129 -0.9044 -0.6976 C 0 0 0 0 0 0 0 0 0 0 0 0
  2502. 0.3682 -1.2519 -0.9487 N 0 0 0 0 0 0 0 0 0 0 0 0
  2503. 1.3253 -0.4980 -0.3651 C 0 0 0 0 0 0 0 0 0 0 0 0
  2504. 1.0589 0.5856 0.4566 C 0 0 0 0 0 0 0 0 0 0 0 0
  2505. -0.5180 1.7615 1.3348 H 0 0 0 0 0 0 0 0 0 0 0 0
  2506. -2.3238 0.3949 0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0
  2507. -1.6631 -1.5256 -1.1781 H 0 0 0 0 0 0 0 0 0 0 0 0
  2508. 2.3464 -0.7977 -0.5825 H 0 0 0 0 0 0 0 0 0 0 0 0
  2509. 1.8678 1.1558 0.8988 H 0 0 0 0 0 0 0 0 0 0 0 0
  2510. 1 2 2 0
  2511. 2 3 1 0
  2512. 3 4 2 0
  2513. 4 5 1 0
  2514. 5 6 2 0
  2515. 6 1 1 0
  2516. 1 7 1 0
  2517. 2 8 1 0
  2518. 3 9 1 0
  2519. 5 10 1 0
  2520. 6 11 1 0
  2521. M END
  2522. $$$$
  2523. RDKit 3D
  2524. 11 11 0 0 0 0 0 0 0 0999 V2000
  2525. -0.2702 0.9143 0.7019 C 0 0 0 0 0 0 0 0 0 0 0 0
  2526. -1.2785 0.1606 0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0
  2527. -0.9129 -0.9000 -0.7033 C 0 0 0 0 0 0 0 0 0 0 0 0
  2528. 0.3682 -1.2459 -0.9565 N 0 0 0 0 0 0 0 0 0 0 0 0
  2529. 1.3253 -0.4957 -0.3683 C 0 0 0 0 0 0 0 0 0 0 0 0
  2530. 1.0589 0.5827 0.4602 C 0 0 0 0 0 0 0 0 0 0 0 0
  2531. -0.5180 1.7531 1.3459 H 0 0 0 0 0 0 0 0 0 0 0 0
  2532. -2.3238 0.3931 0.2787 H 0 0 0 0 0 0 0 0 0 0 0 0
  2533. -1.6631 -1.5182 -1.1876 H 0 0 0 0 0 0 0 0 0 0 0 0
  2534. 2.3464 -0.7941 -0.5875 H 0 0 0 0 0 0 0 0 0 0 0 0
  2535. 1.8678 1.1501 0.9061 H 0 0 0 0 0 0 0 0 0 0 0 0
  2536. 1 2 2 0
  2537. 2 3 1 0
  2538. 3 4 2 0
  2539. 4 5 1 0
  2540. 5 6 2 0
  2541. 6 1 1 0
  2542. 1 7 1 0
  2543. 2 8 1 0
  2544. 3 9 1 0
  2545. 5 10 1 0
  2546. 6 11 1 0
  2547. M END
  2548. $$$$
  2549. RDKit 3D
  2550. 11 11 0 0 0 0 0 0 0 0999 V2000
  2551. -0.2702 0.9098 0.7076 C 0 0 0 0 0 0 0 0 0 0 0 0
  2552. -1.2785 0.1599 0.1114 C 0 0 0 0 0 0 0 0 0 0 0 0
  2553. -0.9129 -0.8955 -0.7089 C 0 0 0 0 0 0 0 0 0 0 0 0
  2554. 0.3682 -1.2399 -0.9643 N 0 0 0 0 0 0 0 0 0 0 0 0
  2555. 1.3253 -0.4934 -0.3714 C 0 0 0 0 0 0 0 0 0 0 0 0
  2556. 1.0589 0.5798 0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0
  2557. -0.5180 1.7446 1.3569 H 0 0 0 0 0 0 0 0 0 0 0 0
  2558. -2.3238 0.3914 0.2812 H 0 0 0 0 0 0 0 0 0 0 0 0
  2559. -1.6631 -1.5107 -1.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
  2560. 2.3464 -0.7904 -0.5925 H 0 0 0 0 0 0 0 0 0 0 0 0
  2561. 1.8678 1.1444 0.9133 H 0 0 0 0 0 0 0 0 0 0 0 0
  2562. 1 2 2 0
  2563. 2 3 1 0
  2564. 3 4 2 0
  2565. 4 5 1 0
  2566. 5 6 2 0
  2567. 6 1 1 0
  2568. 1 7 1 0
  2569. 2 8 1 0
  2570. 3 9 1 0
  2571. 5 10 1 0
  2572. 6 11 1 0
  2573. M END
  2574. $$$$
  2575. RDKit 3D
  2576. 11 11 0 0 0 0 0 0 0 0999 V2000
  2577. -0.2702 0.9054 0.7133 C 0 0 0 0 0 0 0 0 0 0 0 0
  2578. -1.2785 0.1592 0.1124 C 0 0 0 0 0 0 0 0 0 0 0 0
  2579. -0.9129 -0.8911 -0.7145 C 0 0 0 0 0 0 0 0 0 0 0 0
  2580. 0.3682 -1.2338 -0.9721 N 0 0 0 0 0 0 0 0 0 0 0 0
  2581. 1.3253 -0.4911 -0.3745 C 0 0 0 0 0 0 0 0 0 0 0 0
  2582. 1.0589 0.5769 0.4675 C 0 0 0 0 0 0 0 0 0 0 0 0
  2583. -0.5180 1.7360 1.3678 H 0 0 0 0 0 0 0 0 0 0 0 0
  2584. -2.3238 0.3896 0.2836 H 0 0 0 0 0 0 0 0 0 0 0 0
  2585. -1.6631 -1.5032 -1.2066 H 0 0 0 0 0 0 0 0 0 0 0 0
  2586. 2.3464 -0.7866 -0.5975 H 0 0 0 0 0 0 0 0 0 0 0 0
  2587. 1.8678 1.1387 0.9204 H 0 0 0 0 0 0 0 0 0 0 0 0
  2588. 1 2 2 0
  2589. 2 3 1 0
  2590. 3 4 2 0
  2591. 4 5 1 0
  2592. 5 6 2 0
  2593. 6 1 1 0
  2594. 1 7 1 0
  2595. 2 8 1 0
  2596. 3 9 1 0
  2597. 5 10 1 0
  2598. 6 11 1 0
  2599. M END
  2600. $$$$
  2601. RDKit 3D
  2602. 11 11 0 0 0 0 0 0 0 0999 V2000
  2603. -0.2702 0.9009 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0
  2604. -1.2785 0.1585 0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0
  2605. -0.9129 -0.8866 -0.7201 C 0 0 0 0 0 0 0 0 0 0 0 0
  2606. 0.3682 -1.2277 -0.9798 N 0 0 0 0 0 0 0 0 0 0 0 0
  2607. 1.3253 -0.4887 -0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0
  2608. 1.0589 0.5739 0.4711 C 0 0 0 0 0 0 0 0 0 0 0 0
  2609. -0.5180 1.7274 1.3787 H 0 0 0 0 0 0 0 0 0 0 0 0
  2610. -2.3238 0.3878 0.2861 H 0 0 0 0 0 0 0 0 0 0 0 0
  2611. -1.6631 -1.4955 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0
  2612. 2.3464 -0.7828 -0.6024 H 0 0 0 0 0 0 0 0 0 0 0 0
  2613. 1.8678 1.1329 0.9276 H 0 0 0 0 0 0 0 0 0 0 0 0
  2614. 1 2 2 0
  2615. 2 3 1 0
  2616. 3 4 2 0
  2617. 4 5 1 0
  2618. 5 6 2 0
  2619. 6 1 1 0
  2620. 1 7 1 0
  2621. 2 8 1 0
  2622. 3 9 1 0
  2623. 5 10 1 0
  2624. 6 11 1 0
  2625. M END
  2626. $$$$
  2627. RDKit 3D
  2628. 11 11 0 0 0 0 0 0 0 0999 V2000
  2629. -0.2702 0.8963 0.7247 C 0 0 0 0 0 0 0 0 0 0 0 0
  2630. -1.2785 0.1577 0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0
  2631. -0.9129 -0.8820 -0.7256 C 0 0 0 0 0 0 0 0 0 0 0 0
  2632. 0.3682 -1.2215 -0.9875 N 0 0 0 0 0 0 0 0 0 0 0 0
  2633. 1.3253 -0.4863 -0.3806 C 0 0 0 0 0 0 0 0 0 0 0 0
  2634. 1.0589 0.5710 0.4747 C 0 0 0 0 0 0 0 0 0 0 0 0
  2635. -0.5180 1.7187 1.3895 H 0 0 0 0 0 0 0 0 0 0 0 0
  2636. -2.3238 0.3860 0.2885 H 0 0 0 0 0 0 0 0 0 0 0 0
  2637. -1.6631 -1.4879 -1.2254 H 0 0 0 0 0 0 0 0 0 0 0 0
  2638. 2.3464 -0.7790 -0.6073 H 0 0 0 0 0 0 0 0 0 0 0 0
  2639. 1.8678 1.1270 0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0
  2640. 1 2 2 0
  2641. 2 3 1 0
  2642. 3 4 2 0
  2643. 4 5 1 0
  2644. 5 6 2 0
  2645. 6 1 1 0
  2646. 1 7 1 0
  2647. 2 8 1 0
  2648. 3 9 1 0
  2649. 5 10 1 0
  2650. 6 11 1 0
  2651. M END
  2652. $$$$
  2653. RDKit 3D
  2654. 11 11 0 0 0 0 0 0 0 0999 V2000
  2655. -0.2702 0.8918 0.7303 C 0 0 0 0 0 0 0 0 0 0 0 0
  2656. -1.2785 0.1570 0.1154 C 0 0 0 0 0 0 0 0 0 0 0 0
  2657. -0.9129 -0.8774 -0.7312 C 0 0 0 0 0 0 0 0 0 0 0 0
  2658. 0.3682 -1.2152 -0.9952 N 0 0 0 0 0 0 0 0 0 0 0 0
  2659. 1.3253 -0.4839 -0.3837 C 0 0 0 0 0 0 0 0 0 0 0 0
  2660. 1.0589 0.5680 0.4783 C 0 0 0 0 0 0 0 0 0 0 0 0
  2661. -0.5180 1.7099 1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
  2662. -2.3238 0.3842 0.2909 H 0 0 0 0 0 0 0 0 0 0 0 0
  2663. -1.6631 -1.4801 -1.2347 H 0 0 0 0 0 0 0 0 0 0 0 0
  2664. 2.3464 -0.7752 -0.6122 H 0 0 0 0 0 0 0 0 0 0 0 0
  2665. 1.8678 1.1211 0.9417 H 0 0 0 0 0 0 0 0 0 0 0 0
  2666. 1 2 2 0
  2667. 2 3 1 0
  2668. 3 4 2 0
  2669. 4 5 1 0
  2670. 5 6 2 0
  2671. 6 1 1 0
  2672. 1 7 1 0
  2673. 2 8 1 0
  2674. 3 9 1 0
  2675. 5 10 1 0
  2676. 6 11 1 0
  2677. M END
  2678. $$$$
  2679. RDKit 3D
  2680. 11 11 0 0 0 0 0 0 0 0999 V2000
  2681. -0.2702 0.8872 0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0
  2682. -1.2785 0.1563 0.1164 C 0 0 0 0 0 0 0 0 0 0 0 0
  2683. -0.9129 -0.8728 -0.7367 C 0 0 0 0 0 0 0 0 0 0 0 0
  2684. 0.3682 -1.2090 -1.0028 N 0 0 0 0 0 0 0 0 0 0 0 0
  2685. 1.3253 -0.4815 -0.3867 C 0 0 0 0 0 0 0 0 0 0 0 0
  2686. 1.0589 0.5650 0.4819 C 0 0 0 0 0 0 0 0 0 0 0 0
  2687. -0.5180 1.7011 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0
  2688. -2.3238 0.3823 0.2933 H 0 0 0 0 0 0 0 0 0 0 0 0
  2689. -1.6631 -1.4724 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
  2690. 2.3464 -0.7713 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0
  2691. 1.8678 1.1152 0.9488 H 0 0 0 0 0 0 0 0 0 0 0 0
  2692. 1 2 2 0
  2693. 2 3 1 0
  2694. 3 4 2 0
  2695. 4 5 1 0
  2696. 5 6 2 0
  2697. 6 1 1 0
  2698. 1 7 1 0
  2699. 2 8 1 0
  2700. 3 9 1 0
  2701. 5 10 1 0
  2702. 6 11 1 0
  2703. M END
  2704. $$$$
  2705. RDKit 3D
  2706. 11 11 0 0 0 0 0 0 0 0999 V2000
  2707. -0.2702 0.8825 0.7414 C 0 0 0 0 0 0 0 0 0 0 0 0
  2708. -1.2785 0.1556 0.1173 C 0 0 0 0 0 0 0 0 0 0 0 0
  2709. -0.9129 -0.8682 -0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0
  2710. 0.3682 -1.2026 -1.0104 N 0 0 0 0 0 0 0 0 0 0 0 0
  2711. 1.3253 -0.4791 -0.3897 C 0 0 0 0 0 0 0 0 0 0 0 0
  2712. 1.0589 0.5619 0.4854 C 0 0 0 0 0 0 0 0 0 0 0 0
  2713. -0.5180 1.6922 1.4216 H 0 0 0 0 0 0 0 0 0 0 0 0
  2714. -2.3238 0.3805 0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0
  2715. -1.6631 -1.4645 -1.2532 H 0 0 0 0 0 0 0 0 0 0 0 0
  2716. 2.3464 -0.7675 -0.6219 H 0 0 0 0 0 0 0 0 0 0 0 0
  2717. 1.8678 1.1092 0.9558 H 0 0 0 0 0 0 0 0 0 0 0 0
  2718. 1 2 2 0
  2719. 2 3 1 0
  2720. 3 4 2 0
  2721. 4 5 1 0
  2722. 5 6 2 0
  2723. 6 1 1 0
  2724. 1 7 1 0
  2725. 2 8 1 0
  2726. 3 9 1 0
  2727. 5 10 1 0
  2728. 6 11 1 0
  2729. M END
  2730. $$$$
  2731. RDKit 3D
  2732. 11 11 0 0 0 0 0 0 0 0999 V2000
  2733. -0.2702 0.8779 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0
  2734. -1.2785 0.1548 0.1183 C 0 0 0 0 0 0 0 0 0 0 0 0
  2735. -0.9129 -0.8635 -0.7476 C 0 0 0 0 0 0 0 0 0 0 0 0
  2736. 0.3682 -1.1963 -1.0179 N 0 0 0 0 0 0 0 0 0 0 0 0
  2737. 1.3253 -0.4766 -0.3927 C 0 0 0 0 0 0 0 0 0 0 0 0
  2738. 1.0589 0.5589 0.4889 C 0 0 0 0 0 0 0 0 0 0 0 0
  2739. -0.5180 1.6832 1.4322 H 0 0 0 0 0 0 0 0 0 0 0 0
  2740. -2.3238 0.3786 0.2981 H 0 0 0 0 0 0 0 0 0 0 0 0
  2741. -1.6631 -1.4566 -1.2624 H 0 0 0 0 0 0 0 0 0 0 0 0
  2742. 2.3464 -0.7635 -0.6267 H 0 0 0 0 0 0 0 0 0 0 0 0
  2743. 1.8678 1.1032 0.9627 H 0 0 0 0 0 0 0 0 0 0 0 0
  2744. 1 2 2 0
  2745. 2 3 1 0
  2746. 3 4 2 0
  2747. 4 5 1 0
  2748. 5 6 2 0
  2749. 6 1 1 0
  2750. 1 7 1 0
  2751. 2 8 1 0
  2752. 3 9 1 0
  2753. 5 10 1 0
  2754. 6 11 1 0
  2755. M END
  2756. $$$$
  2757. RDKit 3D
  2758. 11 11 0 0 0 0 0 0 0 0999 V2000
  2759. -0.2702 0.8731 0.7525 C 0 0 0 0 0 0 0 0 0 0 0 0
  2760. -1.2785 0.1541 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0
  2761. -0.9129 -0.8588 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0
  2762. 0.3682 -1.1899 -1.0254 N 0 0 0 0 0 0 0 0 0 0 0 0
  2763. 1.3253 -0.4741 -0.3957 C 0 0 0 0 0 0 0 0 0 0 0 0
  2764. 1.0589 0.5558 0.4924 C 0 0 0 0 0 0 0 0 0 0 0 0
  2765. -0.5180 1.6742 1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0
  2766. -2.3238 0.3767 0.3005 H 0 0 0 0 0 0 0 0 0 0 0 0
  2767. -1.6631 -1.4486 -1.2715 H 0 0 0 0 0 0 0 0 0 0 0 0
  2768. 2.3464 -0.7596 -0.6315 H 0 0 0 0 0 0 0 0 0 0 0 0
  2769. 1.8678 1.0971 0.9696 H 0 0 0 0 0 0 0 0 0 0 0 0
  2770. 1 2 2 0
  2771. 2 3 1 0
  2772. 3 4 2 0
  2773. 4 5 1 0
  2774. 5 6 2 0
  2775. 6 1 1 0
  2776. 1 7 1 0
  2777. 2 8 1 0
  2778. 3 9 1 0
  2779. 5 10 1 0
  2780. 6 11 1 0
  2781. M END
  2782. $$$$
  2783. RDKit 3D
  2784. 11 11 0 0 0 0 0 0 0 0999 V2000
  2785. -0.2702 0.8684 0.7579 C 0 0 0 0 0 0 0 0 0 0 0 0
  2786. -1.2785 0.1533 0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0
  2787. -0.9129 -0.8540 -0.7584 C 0 0 0 0 0 0 0 0 0 0 0 0
  2788. 0.3682 -1.1834 -1.0329 N 0 0 0 0 0 0 0 0 0 0 0 0
  2789. 1.3253 -0.4716 -0.3987 C 0 0 0 0 0 0 0 0 0 0 0 0
  2790. 1.0589 0.5527 0.4959 C 0 0 0 0 0 0 0 0 0 0 0 0
  2791. -0.5180 1.6651 1.4533 H 0 0 0 0 0 0 0 0 0 0 0 0
  2792. -2.3238 0.3748 0.3029 H 0 0 0 0 0 0 0 0 0 0 0 0
  2793. -1.6631 -1.4406 -1.2806 H 0 0 0 0 0 0 0 0 0 0 0 0
  2794. 2.3464 -0.7556 -0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0
  2795. 1.8678 1.0910 0.9765 H 0 0 0 0 0 0 0 0 0 0 0 0
  2796. 1 2 2 0
  2797. 2 3 1 0
  2798. 3 4 2 0
  2799. 4 5 1 0
  2800. 5 6 2 0
  2801. 6 1 1 0
  2802. 1 7 1 0
  2803. 2 8 1 0
  2804. 3 9 1 0
  2805. 5 10 1 0
  2806. 6 11 1 0
  2807. M END
  2808. $$$$
  2809. RDKit 3D
  2810. 11 11 0 0 0 0 0 0 0 0999 V2000
  2811. -0.2702 0.8636 0.7634 C 0 0 0 0 0 0 0 0 0 0 0 0
  2812. -1.2785 0.1526 0.1212 C 0 0 0 0 0 0 0 0 0 0 0 0
  2813. -0.9129 -0.8493 -0.7637 C 0 0 0 0 0 0 0 0 0 0 0 0
  2814. 0.3682 -1.1769 -1.0403 N 0 0 0 0 0 0 0 0 0 0 0 0
  2815. 1.3253 -0.4691 -0.4016 C 0 0 0 0 0 0 0 0 0 0 0 0
  2816. 1.0589 0.5495 0.4994 C 0 0 0 0 0 0 0 0 0 0 0 0
  2817. -0.5180 1.6559 1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  2818. -2.3238 0.3729 0.3052 H 0 0 0 0 0 0 0 0 0 0 0 0
  2819. -1.6631 -1.4326 -1.2896 H 0 0 0 0 0 0 0 0 0 0 0 0
  2820. 2.3464 -0.7516 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0
  2821. 1.8678 1.0848 0.9833 H 0 0 0 0 0 0 0 0 0 0 0 0
  2822. 1 2 2 0
  2823. 2 3 1 0
  2824. 3 4 2 0
  2825. 4 5 1 0
  2826. 5 6 2 0
  2827. 6 1 1 0
  2828. 1 7 1 0
  2829. 2 8 1 0
  2830. 3 9 1 0
  2831. 5 10 1 0
  2832. 6 11 1 0
  2833. M END
  2834. $$$$
  2835. RDKit 3D
  2836. 11 11 0 0 0 0 0 0 0 0999 V2000
  2837. -0.2702 0.8588 0.7688 C 0 0 0 0 0 0 0 0 0 0 0 0
  2838. -1.2785 0.1518 0.1222 C 0 0 0 0 0 0 0 0 0 0 0 0
  2839. -0.9129 -0.8444 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0
  2840. 0.3682 -1.1703 -1.0476 N 0 0 0 0 0 0 0 0 0 0 0 0
  2841. 1.3253 -0.4666 -0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0
  2842. 1.0589 0.5464 0.5028 C 0 0 0 0 0 0 0 0 0 0 0 0
  2843. -0.5180 1.6467 1.4741 H 0 0 0 0 0 0 0 0 0 0 0 0
  2844. -2.3238 0.3710 0.3075 H 0 0 0 0 0 0 0 0 0 0 0 0
  2845. -1.6631 -1.4244 -1.2986 H 0 0 0 0 0 0 0 0 0 0 0 0
  2846. 2.3464 -0.7475 -0.6457 H 0 0 0 0 0 0 0 0 0 0 0 0
  2847. 1.8678 1.0786 0.9901 H 0 0 0 0 0 0 0 0 0 0 0 0
  2848. 1 2 2 0
  2849. 2 3 1 0
  2850. 3 4 2 0
  2851. 4 5 1 0
  2852. 5 6 2 0
  2853. 6 1 1 0
  2854. 1 7 1 0
  2855. 2 8 1 0
  2856. 3 9 1 0
  2857. 5 10 1 0
  2858. 6 11 1 0
  2859. M END
  2860. $$$$
  2861. RDKit 3D
  2862. 11 11 0 0 0 0 0 0 0 0999 V2000
  2863. -0.2702 0.8540 0.7742 C 0 0 0 0 0 0 0 0 0 0 0 0
  2864. -1.2785 0.1510 0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0
  2865. -0.9129 -0.8396 -0.7743 C 0 0 0 0 0 0 0 0 0 0 0 0
  2866. 0.3682 -1.1637 -1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0
  2867. 1.3253 -0.4640 -0.4075 C 0 0 0 0 0 0 0 0 0 0 0 0
  2868. 1.0589 0.5432 0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0
  2869. -0.5180 1.6374 1.4844 H 0 0 0 0 0 0 0 0 0 0 0 0
  2870. -2.3238 0.3691 0.3099 H 0 0 0 0 0 0 0 0 0 0 0 0
  2871. -1.6631 -1.4162 -1.3075 H 0 0 0 0 0 0 0 0 0 0 0 0
  2872. 2.3464 -0.7435 -0.6504 H 0 0 0 0 0 0 0 0 0 0 0 0
  2873. 1.8678 1.0724 0.9969 H 0 0 0 0 0 0 0 0 0 0 0 0
  2874. 1 2 2 0
  2875. 2 3 1 0
  2876. 3 4 2 0
  2877. 4 5 1 0
  2878. 5 6 2 0
  2879. 6 1 1 0
  2880. 1 7 1 0
  2881. 2 8 1 0
  2882. 3 9 1 0
  2883. 5 10 1 0
  2884. 6 11 1 0
  2885. M END
  2886. $$$$
  2887. RDKit 3D
  2888. 11 11 0 0 0 0 0 0 0 0999 V2000
  2889. -0.2702 0.8491 0.7795 C 0 0 0 0 0 0 0 0 0 0 0 0
  2890. -1.2785 0.1502 0.1241 C 0 0 0 0 0 0 0 0 0 0 0 0
  2891. -0.9129 -0.8347 -0.7796 C 0 0 0 0 0 0 0 0 0 0 0 0
  2892. 0.3682 -1.1571 -1.0623 N 0 0 0 0 0 0 0 0 0 0 0 0
  2893. 1.3253 -0.4615 -0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0
  2894. 1.0589 0.5400 0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0
  2895. -0.5180 1.6280 1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0
  2896. -2.3238 0.3671 0.3122 H 0 0 0 0 0 0 0 0 0 0 0 0
  2897. -1.6631 -1.4080 -1.3164 H 0 0 0 0 0 0 0 0 0 0 0 0
  2898. 2.3464 -0.7394 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0
  2899. 1.8678 1.0661 1.0036 H 0 0 0 0 0 0 0 0 0 0 0 0
  2900. 1 2 2 0
  2901. 2 3 1 0
  2902. 3 4 2 0
  2903. 4 5 1 0
  2904. 5 6 2 0
  2905. 6 1 1 0
  2906. 1 7 1 0
  2907. 2 8 1 0
  2908. 3 9 1 0
  2909. 5 10 1 0
  2910. 6 11 1 0
  2911. M END
  2912. $$$$
  2913. RDKit 3D
  2914. 11 11 0 0 0 0 0 0 0 0999 V2000
  2915. -0.2702 0.8442 0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0
  2916. -1.2785 0.1495 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0
  2917. -0.9129 -0.8298 -0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0
  2918. 0.3682 -1.1504 -1.0695 N 0 0 0 0 0 0 0 0 0 0 0 0
  2919. 1.3253 -0.4589 -0.4133 C 0 0 0 0 0 0 0 0 0 0 0 0
  2920. 1.0589 0.5368 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0
  2921. -0.5180 1.6186 1.5049 H 0 0 0 0 0 0 0 0 0 0 0 0
  2922. -2.3238 0.3651 0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0
  2923. -1.6631 -1.3997 -1.3252 H 0 0 0 0 0 0 0 0 0 0 0 0
  2924. 2.3464 -0.7352 -0.6597 H 0 0 0 0 0 0 0 0 0 0 0 0
  2925. 1.8678 1.0598 1.0103 H 0 0 0 0 0 0 0 0 0 0 0 0
  2926. 1 2 2 0
  2927. 2 3 1 0
  2928. 3 4 2 0
  2929. 4 5 1 0
  2930. 5 6 2 0
  2931. 6 1 1 0
  2932. 1 7 1 0
  2933. 2 8 1 0
  2934. 3 9 1 0
  2935. 5 10 1 0
  2936. 6 11 1 0
  2937. M END
  2938. $$$$
  2939. RDKit 3D
  2940. 11 11 0 0 0 0 0 0 0 0999 V2000
  2941. -0.2702 0.8392 0.7901 C 0 0 0 0 0 0 0 0 0 0 0 0
  2942. -1.2785 0.1487 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0
  2943. -0.9129 -0.8248 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0
  2944. 0.3682 -1.1436 -1.0767 N 0 0 0 0 0 0 0 0 0 0 0 0
  2945. 1.3253 -0.4563 -0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0
  2946. 1.0589 0.5336 0.5164 C 0 0 0 0 0 0 0 0 0 0 0 0
  2947. -0.5180 1.6091 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0
  2948. -2.3238 0.3632 0.3168 H 0 0 0 0 0 0 0 0 0 0 0 0
  2949. -1.6631 -1.3913 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  2950. 2.3464 -0.7311 -0.6643 H 0 0 0 0 0 0 0 0 0 0 0 0
  2951. 1.8678 1.0534 1.0169 H 0 0 0 0 0 0 0 0 0 0 0 0
  2952. 1 2 2 0
  2953. 2 3 1 0
  2954. 3 4 2 0
  2955. 4 5 1 0
  2956. 5 6 2 0
  2957. 6 1 1 0
  2958. 1 7 1 0
  2959. 2 8 1 0
  2960. 3 9 1 0
  2961. 5 10 1 0
  2962. 6 11 1 0
  2963. M END
  2964. $$$$
  2965. RDKit 3D
  2966. 11 11 0 0 0 0 0 0 0 0999 V2000
  2967. -0.2702 0.8342 0.7954 C 0 0 0 0 0 0 0 0 0 0 0 0
  2968. -1.2785 0.1479 0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0
  2969. -0.9129 -0.8199 -0.7952 C 0 0 0 0 0 0 0 0 0 0 0 0
  2970. 0.3682 -1.1368 -1.0839 N 0 0 0 0 0 0 0 0 0 0 0 0
  2971. 1.3253 -0.4537 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0
  2972. 1.0589 0.5303 0.5197 C 0 0 0 0 0 0 0 0 0 0 0 0
  2973. -0.5180 1.5996 1.5251 H 0 0 0 0 0 0 0 0 0 0 0 0
  2974. -2.3238 0.3612 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0
  2975. -1.6631 -1.3829 -1.3427 H 0 0 0 0 0 0 0 0 0 0 0 0
  2976. 2.3464 -0.7269 -0.6688 H 0 0 0 0 0 0 0 0 0 0 0 0
  2977. 1.8678 1.0470 1.0235 H 0 0 0 0 0 0 0 0 0 0 0 0
  2978. 1 2 2 0
  2979. 2 3 1 0
  2980. 3 4 2 0
  2981. 4 5 1 0
  2982. 5 6 2 0
  2983. 6 1 1 0
  2984. 1 7 1 0
  2985. 2 8 1 0
  2986. 3 9 1 0
  2987. 5 10 1 0
  2988. 6 11 1 0
  2989. M END
  2990. $$$$
  2991. RDKit 3D
  2992. 11 11 0 0 0 0 0 0 0 0999 V2000
  2993. -0.2702 0.8292 0.8006 C 0 0 0 0 0 0 0 0 0 0 0 0
  2994. -1.2785 0.1471 0.1278 C 0 0 0 0 0 0 0 0 0 0 0 0
  2995. -0.9129 -0.8149 -0.8003 C 0 0 0 0 0 0 0 0 0 0 0 0
  2996. 0.3682 -1.1300 -1.0910 N 0 0 0 0 0 0 0 0 0 0 0 0
  2997. 1.3253 -0.4510 -0.4219 C 0 0 0 0 0 0 0 0 0 0 0 0
  2998. 1.0589 0.5270 0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0
  2999. -0.5180 1.5900 1.5351 H 0 0 0 0 0 0 0 0 0 0 0 0
  3000. -2.3238 0.3592 0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0
  3001. -1.6631 -1.3745 -1.3514 H 0 0 0 0 0 0 0 0 0 0 0 0
  3002. 2.3464 -0.7227 -0.6734 H 0 0 0 0 0 0 0 0 0 0 0 0
  3003. 1.8678 1.0405 1.0301 H 0 0 0 0 0 0 0 0 0 0 0 0
  3004. 1 2 2 0
  3005. 2 3 1 0
  3006. 3 4 2 0
  3007. 4 5 1 0
  3008. 5 6 2 0
  3009. 6 1 1 0
  3010. 1 7 1 0
  3011. 2 8 1 0
  3012. 3 9 1 0
  3013. 5 10 1 0
  3014. 6 11 1 0
  3015. M END
  3016. $$$$
  3017. RDKit 3D
  3018. 11 11 0 0 0 0 0 0 0 0999 V2000
  3019. -0.2702 0.8242 0.8058 C 0 0 0 0 0 0 0 0 0 0 0 0
  3020. -1.2785 0.1463 0.1287 C 0 0 0 0 0 0 0 0 0 0 0 0
  3021. -0.9129 -0.8098 -0.8054 C 0 0 0 0 0 0 0 0 0 0 0 0
  3022. 0.3682 -1.1231 -1.0981 N 0 0 0 0 0 0 0 0 0 0 0 0
  3023. 1.3253 -0.4484 -0.4247 C 0 0 0 0 0 0 0 0 0 0 0 0
  3024. 1.0589 0.5238 0.5264 C 0 0 0 0 0 0 0 0 0 0 0 0
  3025. -0.5180 1.5803 1.5451 H 0 0 0 0 0 0 0 0 0 0 0 0
  3026. -2.3238 0.3571 0.3236 H 0 0 0 0 0 0 0 0 0 0 0 0
  3027. -1.6631 -1.3659 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
  3028. 2.3464 -0.7184 -0.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
  3029. 1.8678 1.0340 1.0366 H 0 0 0 0 0 0 0 0 0 0 0 0
  3030. 1 2 2 0
  3031. 2 3 1 0
  3032. 3 4 2 0
  3033. 4 5 1 0
  3034. 5 6 2 0
  3035. 6 1 1 0
  3036. 1 7 1 0
  3037. 2 8 1 0
  3038. 3 9 1 0
  3039. 5 10 1 0
  3040. 6 11 1 0
  3041. M END
  3042. $$$$
  3043. RDKit 3D
  3044. 11 11 0 0 0 0 0 0 0 0999 V2000
  3045. -0.2702 0.8191 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0
  3046. -1.2785 0.1455 0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  3047. -0.9129 -0.8047 -0.8105 C 0 0 0 0 0 0 0 0 0 0 0 0
  3048. 0.3682 -1.1162 -1.1051 N 0 0 0 0 0 0 0 0 0 0 0 0
  3049. 1.3253 -0.4457 -0.4275 C 0 0 0 0 0 0 0 0 0 0 0 0
  3050. 1.0589 0.5204 0.5296 C 0 0 0 0 0 0 0 0 0 0 0 0
  3051. -0.5180 1.5706 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3052. -2.3238 0.3551 0.3258 H 0 0 0 0 0 0 0 0 0 0 0 0
  3053. -1.6631 -1.3574 -1.3686 H 0 0 0 0 0 0 0 0 0 0 0 0
  3054. 2.3464 -0.7142 -0.6824 H 0 0 0 0 0 0 0 0 0 0 0 0
  3055. 1.8678 1.0275 1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0
  3056. 1 2 2 0
  3057. 2 3 1 0
  3058. 3 4 2 0
  3059. 4 5 1 0
  3060. 5 6 2 0
  3061. 6 1 1 0
  3062. 1 7 1 0
  3063. 2 8 1 0
  3064. 3 9 1 0
  3065. 5 10 1 0
  3066. 6 11 1 0
  3067. M END
  3068. $$$$
  3069. RDKit 3D
  3070. 11 11 0 0 0 0 0 0 0 0999 V2000
  3071. -0.2702 0.8140 0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0
  3072. -1.2785 0.1446 0.1306 C 0 0 0 0 0 0 0 0 0 0 0 0
  3073. -0.9129 -0.7996 -0.8155 C 0 0 0 0 0 0 0 0 0 0 0 0
  3074. 0.3682 -1.1092 -1.1121 N 0 0 0 0 0 0 0 0 0 0 0 0
  3075. 1.3253 -0.4430 -0.4303 C 0 0 0 0 0 0 0 0 0 0 0 0
  3076. 1.0589 0.5171 0.5329 C 0 0 0 0 0 0 0 0 0 0 0 0
  3077. -0.5180 1.5608 1.5648 H 0 0 0 0 0 0 0 0 0 0 0 0
  3078. -2.3238 0.3530 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0
  3079. -1.6631 -1.3487 -1.3771 H 0 0 0 0 0 0 0 0 0 0 0 0
  3080. 2.3464 -0.7099 -0.6869 H 0 0 0 0 0 0 0 0 0 0 0 0
  3081. 1.8678 1.0209 1.0495 H 0 0 0 0 0 0 0 0 0 0 0 0
  3082. 1 2 2 0
  3083. 2 3 1 0
  3084. 3 4 2 0
  3085. 4 5 1 0
  3086. 5 6 2 0
  3087. 6 1 1 0
  3088. 1 7 1 0
  3089. 2 8 1 0
  3090. 3 9 1 0
  3091. 5 10 1 0
  3092. 6 11 1 0
  3093. M END
  3094. $$$$
  3095. RDKit 3D
  3096. 11 11 0 0 0 0 0 0 0 0999 V2000
  3097. -0.2702 0.8088 0.8212 C 0 0 0 0 0 0 0 0 0 0 0 0
  3098. -1.2785 0.1438 0.1315 C 0 0 0 0 0 0 0 0 0 0 0 0
  3099. -0.9129 -0.7945 -0.8206 C 0 0 0 0 0 0 0 0 0 0 0 0
  3100. 0.3682 -1.1022 -1.1191 N 0 0 0 0 0 0 0 0 0 0 0 0
  3101. 1.3253 -0.4403 -0.4331 C 0 0 0 0 0 0 0 0 0 0 0 0
  3102. 1.0589 0.5137 0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0
  3103. -0.5180 1.5509 1.5746 H 0 0 0 0 0 0 0 0 0 0 0 0
  3104. -2.3238 0.3510 0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0
  3105. -1.6631 -1.3401 -1.3855 H 0 0 0 0 0 0 0 0 0 0 0 0
  3106. 2.3464 -0.7055 -0.6913 H 0 0 0 0 0 0 0 0 0 0 0 0
  3107. 1.8678 1.0143 1.0559 H 0 0 0 0 0 0 0 0 0 0 0 0
  3108. 1 2 2 0
  3109. 2 3 1 0
  3110. 3 4 2 0
  3111. 4 5 1 0
  3112. 5 6 2 0
  3113. 6 1 1 0
  3114. 1 7 1 0
  3115. 2 8 1 0
  3116. 3 9 1 0
  3117. 5 10 1 0
  3118. 6 11 1 0
  3119. M END
  3120. $$$$
  3121. RDKit 3D
  3122. 11 11 0 0 0 0 0 0 0 0999 V2000
  3123. -0.2702 0.8037 0.8263 C 0 0 0 0 0 0 0 0 0 0 0 0
  3124. -1.2785 0.1430 0.1324 C 0 0 0 0 0 0 0 0 0 0 0 0
  3125. -0.9129 -0.7893 -0.8255 C 0 0 0 0 0 0 0 0 0 0 0 0
  3126. 0.3682 -1.0952 -1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0
  3127. 1.3253 -0.4375 -0.4358 C 0 0 0 0 0 0 0 0 0 0 0 0
  3128. 1.0589 0.5104 0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0
  3129. -0.5180 1.5410 1.5843 H 0 0 0 0 0 0 0 0 0 0 0 0
  3130. -2.3238 0.3489 0.3324 H 0 0 0 0 0 0 0 0 0 0 0 0
  3131. -1.6631 -1.3313 -1.3939 H 0 0 0 0 0 0 0 0 0 0 0 0
  3132. 2.3464 -0.7012 -0.6958 H 0 0 0 0 0 0 0 0 0 0 0 0
  3133. 1.8678 1.0077 1.0623 H 0 0 0 0 0 0 0 0 0 0 0 0
  3134. 1 2 2 0
  3135. 2 3 1 0
  3136. 3 4 2 0
  3137. 4 5 1 0
  3138. 5 6 2 0
  3139. 6 1 1 0
  3140. 1 7 1 0
  3141. 2 8 1 0
  3142. 3 9 1 0
  3143. 5 10 1 0
  3144. 6 11 1 0
  3145. M END
  3146. $$$$
  3147. RDKit 3D
  3148. 11 11 0 0 0 0 0 0 0 0999 V2000
  3149. -0.2702 0.7985 0.8313 C 0 0 0 0 0 0 0 0 0 0 0 0
  3150. -1.2785 0.1422 0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
  3151. -0.9129 -0.7841 -0.8305 C 0 0 0 0 0 0 0 0 0 0 0 0
  3152. 0.3682 -1.0881 -1.1328 N 0 0 0 0 0 0 0 0 0 0 0 0
  3153. 1.3253 -0.4348 -0.4386 C 0 0 0 0 0 0 0 0 0 0 0 0
  3154. 1.0589 0.5070 0.5425 C 0 0 0 0 0 0 0 0 0 0 0 0
  3155. -0.5180 1.5310 1.5939 H 0 0 0 0 0 0 0 0 0 0 0 0
  3156. -2.3238 0.3468 0.3346 H 0 0 0 0 0 0 0 0 0 0 0 0
  3157. -1.6631 -1.3226 -1.4022 H 0 0 0 0 0 0 0 0 0 0 0 0
  3158. 2.3464 -0.6968 -0.7002 H 0 0 0 0 0 0 0 0 0 0 0 0
  3159. 1.8678 1.0010 1.0686 H 0 0 0 0 0 0 0 0 0 0 0 0
  3160. 1 2 2 0
  3161. 2 3 1 0
  3162. 3 4 2 0
  3163. 4 5 1 0
  3164. 5 6 2 0
  3165. 6 1 1 0
  3166. 1 7 1 0
  3167. 2 8 1 0
  3168. 3 9 1 0
  3169. 5 10 1 0
  3170. 6 11 1 0
  3171. M END
  3172. $$$$
  3173. RDKit 3D
  3174. 11 11 0 0 0 0 0 0 0 0999 V2000
  3175. -0.2702 0.7932 0.8363 C 0 0 0 0 0 0 0 0 0 0 0 0
  3176. -1.2785 0.1413 0.1342 C 0 0 0 0 0 0 0 0 0 0 0 0
  3177. -0.9129 -0.7789 -0.8354 C 0 0 0 0 0 0 0 0 0 0 0 0
  3178. 0.3682 -1.0809 -1.1396 N 0 0 0 0 0 0 0 0 0 0 0 0
  3179. 1.3253 -0.4320 -0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0
  3180. 1.0589 0.5035 0.5457 C 0 0 0 0 0 0 0 0 0 0 0 0
  3181. -0.5180 1.5209 1.6035 H 0 0 0 0 0 0 0 0 0 0 0 0
  3182. -2.3238 0.3447 0.3368 H 0 0 0 0 0 0 0 0 0 0 0 0
  3183. -1.6631 -1.3137 -1.4105 H 0 0 0 0 0 0 0 0 0 0 0 0
  3184. 2.3464 -0.6924 -0.7045 H 0 0 0 0 0 0 0 0 0 0 0 0
  3185. 1.8678 0.9942 1.0748 H 0 0 0 0 0 0 0 0 0 0 0 0
  3186. 1 2 2 0
  3187. 2 3 1 0
  3188. 3 4 2 0
  3189. 4 5 1 0
  3190. 5 6 2 0
  3191. 6 1 1 0
  3192. 1 7 1 0
  3193. 2 8 1 0
  3194. 3 9 1 0
  3195. 5 10 1 0
  3196. 6 11 1 0
  3197. M END
  3198. $$$$
  3199. RDKit 3D
  3200. 11 11 0 0 0 0 0 0 0 0999 V2000
  3201. -0.2702 0.7879 0.8413 C 0 0 0 0 0 0 0 0 0 0 0 0
  3202. -1.2785 0.1405 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  3203. -0.9129 -0.7736 -0.8403 C 0 0 0 0 0 0 0 0 0 0 0 0
  3204. 0.3682 -1.0738 -1.1464 N 0 0 0 0 0 0 0 0 0 0 0 0
  3205. 1.3253 -0.4292 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0
  3206. 1.0589 0.5001 0.5489 C 0 0 0 0 0 0 0 0 0 0 0 0
  3207. -0.5180 1.5108 1.6131 H 0 0 0 0 0 0 0 0 0 0 0 0
  3208. -2.3238 0.3426 0.3389 H 0 0 0 0 0 0 0 0 0 0 0 0
  3209. -1.6631 -1.3048 -1.4187 H 0 0 0 0 0 0 0 0 0 0 0 0
  3210. 2.3464 -0.6879 -0.7089 H 0 0 0 0 0 0 0 0 0 0 0 0
  3211. 1.8678 0.9875 1.0811 H 0 0 0 0 0 0 0 0 0 0 0 0
  3212. 1 2 2 0
  3213. 2 3 1 0
  3214. 3 4 2 0
  3215. 4 5 1 0
  3216. 5 6 2 0
  3217. 6 1 1 0
  3218. 1 7 1 0
  3219. 2 8 1 0
  3220. 3 9 1 0
  3221. 5 10 1 0
  3222. 6 11 1 0
  3223. M END
  3224. $$$$
  3225. RDKit 3D
  3226. 11 11 0 0 0 0 0 0 0 0999 V2000
  3227. -0.2702 0.7826 0.8462 C 0 0 0 0 0 0 0 0 0 0 0 0
  3228. -1.2785 0.1396 0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
  3229. -0.9129 -0.7683 -0.8451 C 0 0 0 0 0 0 0 0 0 0 0 0
  3230. 0.3682 -1.0665 -1.1531 N 0 0 0 0 0 0 0 0 0 0 0 0
  3231. 1.3253 -0.4265 -0.4467 C 0 0 0 0 0 0 0 0 0 0 0 0
  3232. 1.0589 0.4966 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0
  3233. -0.5180 1.5007 1.6225 H 0 0 0 0 0 0 0 0 0 0 0 0
  3234. -2.3238 0.3404 0.3411 H 0 0 0 0 0 0 0 0 0 0 0 0
  3235. -1.6631 -1.2959 -1.4269 H 0 0 0 0 0 0 0 0 0 0 0 0
  3236. 2.3464 -0.6835 -0.7132 H 0 0 0 0 0 0 0 0 0 0 0 0
  3237. 1.8678 0.9807 1.0872 H 0 0 0 0 0 0 0 0 0 0 0 0
  3238. 1 2 2 0
  3239. 2 3 1 0
  3240. 3 4 2 0
  3241. 4 5 1 0
  3242. 5 6 2 0
  3243. 6 1 1 0
  3244. 1 7 1 0
  3245. 2 8 1 0
  3246. 3 9 1 0
  3247. 5 10 1 0
  3248. 6 11 1 0
  3249. M END
  3250. $$$$
  3251. RDKit 3D
  3252. 11 11 0 0 0 0 0 0 0 0999 V2000
  3253. -0.2702 0.7773 0.8511 C 0 0 0 0 0 0 0 0 0 0 0 0
  3254. -1.2785 0.1388 0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0
  3255. -0.9129 -0.7630 -0.8499 C 0 0 0 0 0 0 0 0 0 0 0 0
  3256. 0.3682 -1.0593 -1.1598 N 0 0 0 0 0 0 0 0 0 0 0 0
  3257. 1.3253 -0.4236 -0.4493 C 0 0 0 0 0 0 0 0 0 0 0 0
  3258. 1.0589 0.4932 0.5551 C 0 0 0 0 0 0 0 0 0 0 0 0
  3259. -0.5180 1.4904 1.6319 H 0 0 0 0 0 0 0 0 0 0 0 0
  3260. -2.3238 0.3383 0.3432 H 0 0 0 0 0 0 0 0 0 0 0 0
  3261. -1.6631 -1.2869 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  3262. 2.3464 -0.6790 -0.7174 H 0 0 0 0 0 0 0 0 0 0 0 0
  3263. 1.8678 0.9738 1.0934 H 0 0 0 0 0 0 0 0 0 0 0 0
  3264. 1 2 2 0
  3265. 2 3 1 0
  3266. 3 4 2 0
  3267. 4 5 1 0
  3268. 5 6 2 0
  3269. 6 1 1 0
  3270. 1 7 1 0
  3271. 2 8 1 0
  3272. 3 9 1 0
  3273. 5 10 1 0
  3274. 6 11 1 0
  3275. M END
  3276. $$$$
  3277. RDKit 3D
  3278. 11 11 0 0 0 0 0 0 0 0999 V2000
  3279. -0.2702 0.7719 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0
  3280. -1.2785 0.1379 0.1377 C 0 0 0 0 0 0 0 0 0 0 0 0
  3281. -0.9129 -0.7576 -0.8547 C 0 0 0 0 0 0 0 0 0 0 0 0
  3282. 0.3682 -1.0520 -1.1664 N 0 0 0 0 0 0 0 0 0 0 0 0
  3283. 1.3253 -0.4208 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0
  3284. 1.0589 0.4897 0.5582 C 0 0 0 0 0 0 0 0 0 0 0 0
  3285. -0.5180 1.4802 1.6412 H 0 0 0 0 0 0 0 0 0 0 0 0
  3286. -2.3238 0.3361 0.3453 H 0 0 0 0 0 0 0 0 0 0 0 0
  3287. -1.6631 -1.2779 -1.4431 H 0 0 0 0 0 0 0 0 0 0 0 0
  3288. 2.3464 -0.6744 -0.7217 H 0 0 0 0 0 0 0 0 0 0 0 0
  3289. 1.8678 0.9669 1.0995 H 0 0 0 0 0 0 0 0 0 0 0 0
  3290. 1 2 2 0
  3291. 2 3 1 0
  3292. 3 4 2 0
  3293. 4 5 1 0
  3294. 5 6 2 0
  3295. 6 1 1 0
  3296. 1 7 1 0
  3297. 2 8 1 0
  3298. 3 9 1 0
  3299. 5 10 1 0
  3300. 6 11 1 0
  3301. M END
  3302. $$$$
  3303. RDKit 3D
  3304. 11 11 0 0 0 0 0 0 0 0999 V2000
  3305. -0.2702 0.7666 0.8608 C 0 0 0 0 0 0 0 0 0 0 0 0
  3306. -1.2785 0.1370 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0
  3307. -0.9129 -0.7523 -0.8594 C 0 0 0 0 0 0 0 0 0 0 0 0
  3308. 0.3682 -1.0446 -1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0
  3309. 1.3253 -0.4180 -0.4546 C 0 0 0 0 0 0 0 0 0 0 0 0
  3310. 1.0589 0.4862 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0
  3311. -0.5180 1.4698 1.6505 H 0 0 0 0 0 0 0 0 0 0 0 0
  3312. -2.3238 0.3339 0.3474 H 0 0 0 0 0 0 0 0 0 0 0 0
  3313. -1.6631 -1.2688 -1.4511 H 0 0 0 0 0 0 0 0 0 0 0 0
  3314. 2.3464 -0.6699 -0.7259 H 0 0 0 0 0 0 0 0 0 0 0 0
  3315. 1.8678 0.9600 1.1055 H 0 0 0 0 0 0 0 0 0 0 0 0
  3316. 1 2 2 0
  3317. 2 3 1 0
  3318. 3 4 2 0
  3319. 4 5 1 0
  3320. 5 6 2 0
  3321. 6 1 1 0
  3322. 1 7 1 0
  3323. 2 8 1 0
  3324. 3 9 1 0
  3325. 5 10 1 0
  3326. 6 11 1 0
  3327. M END
  3328. $$$$
  3329. RDKit 3D
  3330. 11 11 0 0 0 0 0 0 0 0999 V2000
  3331. -0.2702 0.7611 0.8656 C 0 0 0 0 0 0 0 0 0 0 0 0
  3332. -1.2785 0.1362 0.1394 C 0 0 0 0 0 0 0 0 0 0 0 0
  3333. -0.9129 -0.7468 -0.8641 C 0 0 0 0 0 0 0 0 0 0 0 0
  3334. 0.3682 -1.0372 -1.1796 N 0 0 0 0 0 0 0 0 0 0 0 0
  3335. 1.3253 -0.4151 -0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0
  3336. 1.0589 0.4826 0.5643 C 0 0 0 0 0 0 0 0 0 0 0 0
  3337. -0.5180 1.4594 1.6597 H 0 0 0 0 0 0 0 0 0 0 0 0
  3338. -2.3238 0.3317 0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0
  3339. -1.6631 -1.2596 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0
  3340. 2.3464 -0.6653 -0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0
  3341. 1.8678 0.9530 1.1115 H 0 0 0 0 0 0 0 0 0 0 0 0
  3342. 1 2 2 0
  3343. 2 3 1 0
  3344. 3 4 2 0
  3345. 4 5 1 0
  3346. 5 6 2 0
  3347. 6 1 1 0
  3348. 1 7 1 0
  3349. 2 8 1 0
  3350. 3 9 1 0
  3351. 5 10 1 0
  3352. 6 11 1 0
  3353. M END
  3354. $$$$
  3355. RDKit 3D
  3356. 11 11 0 0 0 0 0 0 0 0999 V2000
  3357. -0.2702 0.7557 0.8704 C 0 0 0 0 0 0 0 0 0 0 0 0
  3358. -1.2785 0.1353 0.1402 C 0 0 0 0 0 0 0 0 0 0 0 0
  3359. -0.9129 -0.7414 -0.8688 C 0 0 0 0 0 0 0 0 0 0 0 0
  3360. 0.3682 -1.0298 -1.1861 N 0 0 0 0 0 0 0 0 0 0 0 0
  3361. 1.3253 -0.4122 -0.4599 C 0 0 0 0 0 0 0 0 0 0 0 0
  3362. 1.0589 0.4791 0.5673 C 0 0 0 0 0 0 0 0 0 0 0 0
  3363. -0.5180 1.4490 1.6689 H 0 0 0 0 0 0 0 0 0 0 0 0
  3364. -2.3238 0.3295 0.3516 H 0 0 0 0 0 0 0 0 0 0 0 0
  3365. -1.6631 -1.2504 -1.4669 H 0 0 0 0 0 0 0 0 0 0 0 0
  3366. 2.3464 -0.6607 -0.7343 H 0 0 0 0 0 0 0 0 0 0 0 0
  3367. 1.8678 0.9460 1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0
  3368. 1 2 2 0
  3369. 2 3 1 0
  3370. 3 4 2 0
  3371. 4 5 1 0
  3372. 5 6 2 0
  3373. 6 1 1 0
  3374. 1 7 1 0
  3375. 2 8 1 0
  3376. 3 9 1 0
  3377. 5 10 1 0
  3378. 6 11 1 0
  3379. M END
  3380. $$$$
  3381. RDKit 3D
  3382. 11 11 0 0 0 0 0 0 0 0999 V2000
  3383. -0.2702 0.7502 0.8751 C 0 0 0 0 0 0 0 0 0 0 0 0
  3384. -1.2785 0.1344 0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0
  3385. -0.9129 -0.7359 -0.8735 C 0 0 0 0 0 0 0 0 0 0 0 0
  3386. 0.3682 -1.0223 -1.1925 N 0 0 0 0 0 0 0 0 0 0 0 0
  3387. 1.3253 -0.4093 -0.4624 C 0 0 0 0 0 0 0 0 0 0 0 0
  3388. 1.0589 0.4755 0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0
  3389. -0.5180 1.4384 1.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
  3390. -2.3238 0.3273 0.3537 H 0 0 0 0 0 0 0 0 0 0 0 0
  3391. -1.6631 -1.2412 -1.4747 H 0 0 0 0 0 0 0 0 0 0 0 0
  3392. 2.3464 -0.6561 -0.7384 H 0 0 0 0 0 0 0 0 0 0 0 0
  3393. 1.8678 0.9390 1.1234 H 0 0 0 0 0 0 0 0 0 0 0 0
  3394. 1 2 2 0
  3395. 2 3 1 0
  3396. 3 4 2 0
  3397. 4 5 1 0
  3398. 5 6 2 0
  3399. 6 1 1 0
  3400. 1 7 1 0
  3401. 2 8 1 0
  3402. 3 9 1 0
  3403. 5 10 1 0
  3404. 6 11 1 0
  3405. M END
  3406. $$$$
  3407. RDKit 3D
  3408. 11 11 0 0 0 0 0 0 0 0999 V2000
  3409. -0.2702 0.7447 0.8798 C 0 0 0 0 0 0 0 0 0 0 0 0
  3410. -1.2785 0.1335 0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  3411. -0.9129 -0.7304 -0.8781 C 0 0 0 0 0 0 0 0 0 0 0 0
  3412. 0.3682 -1.0148 -1.1989 N 0 0 0 0 0 0 0 0 0 0 0 0
  3413. 1.3253 -0.4064 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0
  3414. 1.0589 0.4719 0.5733 C 0 0 0 0 0 0 0 0 0 0 0 0
  3415. -0.5180 1.4279 1.6869 H 0 0 0 0 0 0 0 0 0 0 0 0
  3416. -2.3238 0.3251 0.3557 H 0 0 0 0 0 0 0 0 0 0 0 0
  3417. -1.6631 -1.2319 -1.4825 H 0 0 0 0 0 0 0 0 0 0 0 0
  3418. 2.3464 -0.6514 -0.7425 H 0 0 0 0 0 0 0 0 0 0 0 0
  3419. 1.8678 0.9319 1.1293 H 0 0 0 0 0 0 0 0 0 0 0 0
  3420. 1 2 2 0
  3421. 2 3 1 0
  3422. 3 4 2 0
  3423. 4 5 1 0
  3424. 5 6 2 0
  3425. 6 1 1 0
  3426. 1 7 1 0
  3427. 2 8 1 0
  3428. 3 9 1 0
  3429. 5 10 1 0
  3430. 6 11 1 0
  3431. M END
  3432. $$$$
  3433. RDKit 3D
  3434. 11 11 0 0 0 0 0 0 0 0999 V2000
  3435. -0.2702 0.7391 0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0
  3436. -1.2785 0.1326 0.1428 C 0 0 0 0 0 0 0 0 0 0 0 0
  3437. -0.9129 -0.7249 -0.8826 C 0 0 0 0 0 0 0 0 0 0 0 0
  3438. 0.3682 -1.0072 -1.2053 N 0 0 0 0 0 0 0 0 0 0 0 0
  3439. 1.3253 -0.4035 -0.4675 C 0 0 0 0 0 0 0 0 0 0 0 0
  3440. 1.0589 0.4683 0.5763 C 0 0 0 0 0 0 0 0 0 0 0 0
  3441. -0.5180 1.4173 1.6959 H 0 0 0 0 0 0 0 0 0 0 0 0
  3442. -2.3238 0.3228 0.3578 H 0 0 0 0 0 0 0 0 0 0 0 0
  3443. -1.6631 -1.2226 -1.4902 H 0 0 0 0 0 0 0 0 0 0 0 0
  3444. 2.3464 -0.6468 -0.7466 H 0 0 0 0 0 0 0 0 0 0 0 0
  3445. 1.8678 0.9248 1.1351 H 0 0 0 0 0 0 0 0 0 0 0 0
  3446. 1 2 2 0
  3447. 2 3 1 0
  3448. 3 4 2 0
  3449. 4 5 1 0
  3450. 5 6 2 0
  3451. 6 1 1 0
  3452. 1 7 1 0
  3453. 2 8 1 0
  3454. 3 9 1 0
  3455. 5 10 1 0
  3456. 6 11 1 0
  3457. M END
  3458. $$$$
  3459. RDKit 3D
  3460. 11 11 0 0 0 0 0 0 0 0999 V2000
  3461. -0.2702 0.7336 0.8891 C 0 0 0 0 0 0 0 0 0 0 0 0
  3462. -1.2785 0.1317 0.1436 C 0 0 0 0 0 0 0 0 0 0 0 0
  3463. -0.9129 -0.7193 -0.8872 C 0 0 0 0 0 0 0 0 0 0 0 0
  3464. 0.3682 -0.9997 -1.2116 N 0 0 0 0 0 0 0 0 0 0 0 0
  3465. 1.3253 -0.4005 -0.4701 C 0 0 0 0 0 0 0 0 0 0 0 0
  3466. 1.0589 0.4647 0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0
  3467. -0.5180 1.4066 1.7047 H 0 0 0 0 0 0 0 0 0 0 0 0
  3468. -2.3238 0.3206 0.3598 H 0 0 0 0 0 0 0 0 0 0 0 0
  3469. -1.6631 -1.2132 -1.4979 H 0 0 0 0 0 0 0 0 0 0 0 0
  3470. 2.3464 -0.6421 -0.7506 H 0 0 0 0 0 0 0 0 0 0 0 0
  3471. 1.8678 0.9176 1.1409 H 0 0 0 0 0 0 0 0 0 0 0 0
  3472. 1 2 2 0
  3473. 2 3 1 0
  3474. 3 4 2 0
  3475. 4 5 1 0
  3476. 5 6 2 0
  3477. 6 1 1 0
  3478. 1 7 1 0
  3479. 2 8 1 0
  3480. 3 9 1 0
  3481. 5 10 1 0
  3482. 6 11 1 0
  3483. M END
  3484. $$$$
  3485. RDKit 3D
  3486. 11 11 0 0 0 0 0 0 0 0999 V2000
  3487. -0.2702 0.7280 0.8937 C 0 0 0 0 0 0 0 0 0 0 0 0
  3488. -1.2785 0.1308 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
  3489. -0.9129 -0.7137 -0.8917 C 0 0 0 0 0 0 0 0 0 0 0 0
  3490. 0.3682 -0.9920 -1.2178 N 0 0 0 0 0 0 0 0 0 0 0 0
  3491. 1.3253 -0.3976 -0.4726 C 0 0 0 0 0 0 0 0 0 0 0 0
  3492. 1.0589 0.4610 0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0
  3493. -0.5180 1.3958 1.7135 H 0 0 0 0 0 0 0 0 0 0 0 0
  3494. -2.3238 0.3183 0.3618 H 0 0 0 0 0 0 0 0 0 0 0 0
  3495. -1.6631 -1.2037 -1.5055 H 0 0 0 0 0 0 0 0 0 0 0 0
  3496. 2.3464 -0.6373 -0.7547 H 0 0 0 0 0 0 0 0 0 0 0 0
  3497. 1.8678 0.9105 1.1467 H 0 0 0 0 0 0 0 0 0 0 0 0
  3498. 1 2 2 0
  3499. 2 3 1 0
  3500. 3 4 2 0
  3501. 4 5 1 0
  3502. 5 6 2 0
  3503. 6 1 1 0
  3504. 1 7 1 0
  3505. 2 8 1 0
  3506. 3 9 1 0
  3507. 5 10 1 0
  3508. 6 11 1 0
  3509. M END
  3510. $$$$
  3511. RDKit 3D
  3512. 11 11 0 0 0 0 0 0 0 0999 V2000
  3513. -0.2702 0.7223 0.8982 C 0 0 0 0 0 0 0 0 0 0 0 0
  3514. -1.2785 0.1299 0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0
  3515. -0.9129 -0.7081 -0.8961 C 0 0 0 0 0 0 0 0 0 0 0 0
  3516. 0.3682 -0.9843 -1.2240 N 0 0 0 0 0 0 0 0 0 0 0 0
  3517. 1.3253 -0.3946 -0.4751 C 0 0 0 0 0 0 0 0 0 0 0 0
  3518. 1.0589 0.4573 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0
  3519. -0.5180 1.3850 1.7223 H 0 0 0 0 0 0 0 0 0 0 0 0
  3520. -2.3238 0.3160 0.3638 H 0 0 0 0 0 0 0 0 0 0 0 0
  3521. -1.6631 -1.1943 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0
  3522. 2.3464 -0.6326 -0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0
  3523. 1.8678 0.9032 1.1524 H 0 0 0 0 0 0 0 0 0 0 0 0
  3524. 1 2 2 0
  3525. 2 3 1 0
  3526. 3 4 2 0
  3527. 4 5 1 0
  3528. 5 6 2 0
  3529. 6 1 1 0
  3530. 1 7 1 0
  3531. 2 8 1 0
  3532. 3 9 1 0
  3533. 5 10 1 0
  3534. 6 11 1 0
  3535. M END
  3536. $$$$
  3537. RDKit 3D
  3538. 11 11 0 0 0 0 0 0 0 0999 V2000
  3539. -0.2702 0.7167 0.9027 C 0 0 0 0 0 0 0 0 0 0 0 0
  3540. -1.2785 0.1290 0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0
  3541. -0.9129 -0.7025 -0.9006 C 0 0 0 0 0 0 0 0 0 0 0 0
  3542. 0.3682 -0.9766 -1.2302 N 0 0 0 0 0 0 0 0 0 0 0 0
  3543. 1.3253 -0.3916 -0.4775 C 0 0 0 0 0 0 0 0 0 0 0 0
  3544. 1.0589 0.4537 0.5879 C 0 0 0 0 0 0 0 0 0 0 0 0
  3545. -0.5180 1.3742 1.7309 H 0 0 0 0 0 0 0 0 0 0 0 0
  3546. -2.3238 0.3138 0.3658 H 0 0 0 0 0 0 0 0 0 0 0 0
  3547. -1.6631 -1.1847 -1.5205 H 0 0 0 0 0 0 0 0 0 0 0 0
  3548. 2.3464 -0.6278 -0.7626 H 0 0 0 0 0 0 0 0 0 0 0 0
  3549. 1.8678 0.8960 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0
  3550. 1 2 2 0
  3551. 2 3 1 0
  3552. 3 4 2 0
  3553. 4 5 1 0
  3554. 5 6 2 0
  3555. 6 1 1 0
  3556. 1 7 1 0
  3557. 2 8 1 0
  3558. 3 9 1 0
  3559. 5 10 1 0
  3560. 6 11 1 0
  3561. M END
  3562. $$$$
  3563. RDKit 3D
  3564. 11 11 0 0 0 0 0 0 0 0999 V2000
  3565. -0.2702 0.7110 0.9072 C 0 0 0 0 0 0 0 0 0 0 0 0
  3566. -1.2785 0.1281 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0
  3567. -0.9129 -0.6968 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0
  3568. 0.3682 -0.9689 -1.2363 N 0 0 0 0 0 0 0 0 0 0 0 0
  3569. 1.3253 -0.3886 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0
  3570. 1.0589 0.4500 0.5907 C 0 0 0 0 0 0 0 0 0 0 0 0
  3571. -0.5180 1.3633 1.7395 H 0 0 0 0 0 0 0 0 0 0 0 0
  3572. -2.3238 0.3115 0.3677 H 0 0 0 0 0 0 0 0 0 0 0 0
  3573. -1.6631 -1.1751 -1.5279 H 0 0 0 0 0 0 0 0 0 0 0 0
  3574. 2.3464 -0.6230 -0.7665 H 0 0 0 0 0 0 0 0 0 0 0 0
  3575. 1.8678 0.8887 1.1636 H 0 0 0 0 0 0 0 0 0 0 0 0
  3576. 1 2 2 0
  3577. 2 3 1 0
  3578. 3 4 2 0
  3579. 4 5 1 0
  3580. 5 6 2 0
  3581. 6 1 1 0
  3582. 1 7 1 0
  3583. 2 8 1 0
  3584. 3 9 1 0
  3585. 5 10 1 0
  3586. 6 11 1 0
  3587. M END
  3588. $$$$
  3589. RDKit 3D
  3590. 11 11 0 0 0 0 0 0 0 0999 V2000
  3591. -0.2702 0.7053 0.9117 C 0 0 0 0 0 0 0 0 0 0 0 0
  3592. -1.2785 0.1271 0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0
  3593. -0.9129 -0.6911 -0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0
  3594. 0.3682 -0.9611 -1.2424 N 0 0 0 0 0 0 0 0 0 0 0 0
  3595. 1.3253 -0.3856 -0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0
  3596. 1.0589 0.4462 0.5935 C 0 0 0 0 0 0 0 0 0 0 0 0
  3597. -0.5180 1.3523 1.7481 H 0 0 0 0 0 0 0 0 0 0 0 0
  3598. -2.3238 0.3091 0.3697 H 0 0 0 0 0 0 0 0 0 0 0 0
  3599. -1.6631 -1.1655 -1.5352 H 0 0 0 0 0 0 0 0 0 0 0 0
  3600. 2.3464 -0.6182 -0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0
  3601. 1.8678 0.8813 1.1692 H 0 0 0 0 0 0 0 0 0 0 0 0
  3602. 1 2 2 0
  3603. 2 3 1 0
  3604. 3 4 2 0
  3605. 4 5 1 0
  3606. 5 6 2 0
  3607. 6 1 1 0
  3608. 1 7 1 0
  3609. 2 8 1 0
  3610. 3 9 1 0
  3611. 5 10 1 0
  3612. 6 11 1 0
  3613. M END
  3614. $$$$
  3615. RDKit 3D
  3616. 11 11 0 0 0 0 0 0 0 0999 V2000
  3617. -0.2702 0.6995 0.9161 C 0 0 0 0 0 0 0 0 0 0 0 0
  3618. -1.2785 0.1262 0.1485 C 0 0 0 0 0 0 0 0 0 0 0 0
  3619. -0.9129 -0.6854 -0.9137 C 0 0 0 0 0 0 0 0 0 0 0 0
  3620. 0.3682 -0.9533 -1.2484 N 0 0 0 0 0 0 0 0 0 0 0 0
  3621. 1.3253 -0.3825 -0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0
  3622. 1.0589 0.4425 0.5963 C 0 0 0 0 0 0 0 0 0 0 0 0
  3623. -0.5180 1.3413 1.7565 H 0 0 0 0 0 0 0 0 0 0 0 0
  3624. -2.3238 0.3068 0.3716 H 0 0 0 0 0 0 0 0 0 0 0 0
  3625. -1.6631 -1.1559 -1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0
  3626. 2.3464 -0.6133 -0.7743 H 0 0 0 0 0 0 0 0 0 0 0 0
  3627. 1.8678 0.8740 1.1747 H 0 0 0 0 0 0 0 0 0 0 0 0
  3628. 1 2 2 0
  3629. 2 3 1 0
  3630. 3 4 2 0
  3631. 4 5 1 0
  3632. 5 6 2 0
  3633. 6 1 1 0
  3634. 1 7 1 0
  3635. 2 8 1 0
  3636. 3 9 1 0
  3637. 5 10 1 0
  3638. 6 11 1 0
  3639. M END
  3640. $$$$
  3641. RDKit 3D
  3642. 11 11 0 0 0 0 0 0 0 0999 V2000
  3643. -0.2702 0.6938 0.9205 C 0 0 0 0 0 0 0 0 0 0 0 0
  3644. -1.2785 0.1253 0.1492 C 0 0 0 0 0 0 0 0 0 0 0 0
  3645. -0.9129 -0.6796 -0.9179 C 0 0 0 0 0 0 0 0 0 0 0 0
  3646. 0.3682 -0.9454 -1.2543 N 0 0 0 0 0 0 0 0 0 0 0 0
  3647. 1.3253 -0.3795 -0.4872 C 0 0 0 0 0 0 0 0 0 0 0 0
  3648. 1.0589 0.4387 0.5991 C 0 0 0 0 0 0 0 0 0 0 0 0
  3649. -0.5180 1.3303 1.7649 H 0 0 0 0 0 0 0 0 0 0 0 0
  3650. -2.3238 0.3045 0.3735 H 0 0 0 0 0 0 0 0 0 0 0 0
  3651. -1.6631 -1.1461 -1.5498 H 0 0 0 0 0 0 0 0 0 0 0 0
  3652. 2.3464 -0.6084 -0.7782 H 0 0 0 0 0 0 0 0 0 0 0 0
  3653. 1.8678 0.8666 1.1802 H 0 0 0 0 0 0 0 0 0 0 0 0
  3654. 1 2 2 0
  3655. 2 3 1 0
  3656. 3 4 2 0
  3657. 4 5 1 0
  3658. 5 6 2 0
  3659. 6 1 1 0
  3660. 1 7 1 0
  3661. 2 8 1 0
  3662. 3 9 1 0
  3663. 5 10 1 0
  3664. 6 11 1 0
  3665. M END
  3666. $$$$
  3667. RDKit 3D
  3668. 11 11 0 0 0 0 0 0 0 0999 V2000
  3669. -0.2702 0.6880 0.9248 C 0 0 0 0 0 0 0 0 0 0 0 0
  3670. -1.2785 0.1243 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
  3671. -0.9129 -0.6738 -0.9222 C 0 0 0 0 0 0 0 0 0 0 0 0
  3672. 0.3682 -0.9375 -1.2603 N 0 0 0 0 0 0 0 0 0 0 0 0
  3673. 1.3253 -0.3764 -0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0
  3674. 1.0589 0.4350 0.6018 C 0 0 0 0 0 0 0 0 0 0 0 0
  3675. -0.5180 1.3191 1.7733 H 0 0 0 0 0 0 0 0 0 0 0 0
  3676. -2.3238 0.3021 0.3754 H 0 0 0 0 0 0 0 0 0 0 0 0
  3677. -1.6631 -1.1364 -1.5569 H 0 0 0 0 0 0 0 0 0 0 0 0
  3678. 2.3464 -0.6035 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0
  3679. 1.8678 0.8592 1.1856 H 0 0 0 0 0 0 0 0 0 0 0 0
  3680. 1 2 2 0
  3681. 2 3 1 0
  3682. 3 4 2 0
  3683. 4 5 1 0
  3684. 5 6 2 0
  3685. 6 1 1 0
  3686. 1 7 1 0
  3687. 2 8 1 0
  3688. 3 9 1 0
  3689. 5 10 1 0
  3690. 6 11 1 0
  3691. M END
  3692. $$$$
  3693. RDKit 3D
  3694. 11 11 0 0 0 0 0 0 0 0999 V2000
  3695. -0.2702 0.6821 0.9291 C 0 0 0 0 0 0 0 0 0 0 0 0
  3696. -1.2785 0.1234 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0
  3697. -0.9129 -0.6680 -0.9264 C 0 0 0 0 0 0 0 0 0 0 0 0
  3698. 0.3682 -0.9296 -1.2661 N 0 0 0 0 0 0 0 0 0 0 0 0
  3699. 1.3253 -0.3733 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0
  3700. 1.0589 0.4312 0.6045 C 0 0 0 0 0 0 0 0 0 0 0 0
  3701. -0.5180 1.3080 1.7815 H 0 0 0 0 0 0 0 0 0 0 0 0
  3702. -2.3238 0.2997 0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0
  3703. -1.6631 -1.1266 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0
  3704. 2.3464 -0.5986 -0.7857 H 0 0 0 0 0 0 0 0 0 0 0 0
  3705. 1.8678 0.8517 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0
  3706. 1 2 2 0
  3707. 2 3 1 0
  3708. 3 4 2 0
  3709. 4 5 1 0
  3710. 5 6 2 0
  3711. 6 1 1 0
  3712. 1 7 1 0
  3713. 2 8 1 0
  3714. 3 9 1 0
  3715. 5 10 1 0
  3716. 6 11 1 0
  3717. M END
  3718. $$$$
  3719. RDKit 3D
  3720. 11 11 0 0 0 0 0 0 0 0999 V2000
  3721. -0.2702 0.6763 0.9334 C 0 0 0 0 0 0 0 0 0 0 0 0
  3722. -1.2785 0.1224 0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0
  3723. -0.9129 -0.6622 -0.9306 C 0 0 0 0 0 0 0 0 0 0 0 0
  3724. 0.3682 -0.9216 -1.2719 N 0 0 0 0 0 0 0 0 0 0 0 0
  3725. 1.3253 -0.3702 -0.4943 C 0 0 0 0 0 0 0 0 0 0 0 0
  3726. 1.0589 0.4274 0.6072 C 0 0 0 0 0 0 0 0 0 0 0 0
  3727. -0.5180 1.2968 1.7897 H 0 0 0 0 0 0 0 0 0 0 0 0
  3728. -2.3238 0.2974 0.3792 H 0 0 0 0 0 0 0 0 0 0 0 0
  3729. -1.6631 -1.1167 -1.5711 H 0 0 0 0 0 0 0 0 0 0 0 0
  3730. 2.3464 -0.5937 -0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0
  3731. 1.8678 0.8442 1.1963 H 0 0 0 0 0 0 0 0 0 0 0 0
  3732. 1 2 2 0
  3733. 2 3 1 0
  3734. 3 4 2 0
  3735. 4 5 1 0
  3736. 5 6 2 0
  3737. 6 1 1 0
  3738. 1 7 1 0
  3739. 2 8 1 0
  3740. 3 9 1 0
  3741. 5 10 1 0
  3742. 6 11 1 0
  3743. M END
  3744. $$$$
  3745. RDKit 3D
  3746. 11 11 0 0 0 0 0 0 0 0999 V2000
  3747. -0.2702 0.6704 0.9376 C 0 0 0 0 0 0 0 0 0 0 0 0
  3748. -1.2785 0.1215 0.1523 C 0 0 0 0 0 0 0 0 0 0 0 0
  3749. -0.9129 -0.6563 -0.9347 C 0 0 0 0 0 0 0 0 0 0 0 0
  3750. 0.3682 -0.9136 -1.2777 N 0 0 0 0 0 0 0 0 0 0 0 0
  3751. 1.3253 -0.3671 -0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0
  3752. 1.0589 0.4235 0.6099 C 0 0 0 0 0 0 0 0 0 0 0 0
  3753. -0.5180 1.2855 1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0
  3754. -2.3238 0.2950 0.3811 H 0 0 0 0 0 0 0 0 0 0 0 0
  3755. -1.6631 -1.1068 -1.5781 H 0 0 0 0 0 0 0 0 0 0 0 0
  3756. 2.3464 -0.5887 -0.7932 H 0 0 0 0 0 0 0 0 0 0 0 0
  3757. 1.8678 0.8367 1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0
  3758. 1 2 2 0
  3759. 2 3 1 0
  3760. 3 4 2 0
  3761. 4 5 1 0
  3762. 5 6 2 0
  3763. 6 1 1 0
  3764. 1 7 1 0
  3765. 2 8 1 0
  3766. 3 9 1 0
  3767. 5 10 1 0
  3768. 6 11 1 0
  3769. M END
  3770. $$$$
  3771. RDKit 3D
  3772. 11 11 0 0 0 0 0 0 0 0999 V2000
  3773. -0.2702 0.6645 0.9418 C 0 0 0 0 0 0 0 0 0 0 0 0
  3774. -1.2785 0.1205 0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0
  3775. -0.9129 -0.6505 -0.9388 C 0 0 0 0 0 0 0 0 0 0 0 0
  3776. 0.3682 -0.9055 -1.2834 N 0 0 0 0 0 0 0 0 0 0 0 0
  3777. 1.3253 -0.3640 -0.4989 C 0 0 0 0 0 0 0 0 0 0 0 0
  3778. 1.0589 0.4197 0.6126 C 0 0 0 0 0 0 0 0 0 0 0 0
  3779. -0.5180 1.2742 1.8058 H 0 0 0 0 0 0 0 0 0 0 0 0
  3780. -2.3238 0.2926 0.3829 H 0 0 0 0 0 0 0 0 0 0 0 0
  3781. -1.6631 -1.0969 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0
  3782. 2.3464 -0.5837 -0.7969 H 0 0 0 0 0 0 0 0 0 0 0 0
  3783. 1.8678 0.8291 1.2068 H 0 0 0 0 0 0 0 0 0 0 0 0
  3784. 1 2 2 0
  3785. 2 3 1 0
  3786. 3 4 2 0
  3787. 4 5 1 0
  3788. 5 6 2 0
  3789. 6 1 1 0
  3790. 1 7 1 0
  3791. 2 8 1 0
  3792. 3 9 1 0
  3793. 5 10 1 0
  3794. 6 11 1 0
  3795. M END
  3796. $$$$
  3797. RDKit 3D
  3798. 11 11 0 0 0 0 0 0 0 0999 V2000
  3799. -0.2702 0.6586 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0
  3800. -1.2785 0.1196 0.1539 C 0 0 0 0 0 0 0 0 0 0 0 0
  3801. -0.9129 -0.6445 -0.9429 C 0 0 0 0 0 0 0 0 0 0 0 0
  3802. 0.3682 -0.8975 -1.2891 N 0 0 0 0 0 0 0 0 0 0 0 0
  3803. 1.3253 -0.3608 -0.5012 C 0 0 0 0 0 0 0 0 0 0 0 0
  3804. 1.0589 0.4158 0.6152 C 0 0 0 0 0 0 0 0 0 0 0 0
  3805. -0.5180 1.2628 1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0
  3806. -2.3238 0.2902 0.3847 H 0 0 0 0 0 0 0 0 0 0 0 0
  3807. -1.6631 -1.0869 -1.5919 H 0 0 0 0 0 0 0 0 0 0 0 0
  3808. 2.3464 -0.5787 -0.8005 H 0 0 0 0 0 0 0 0 0 0 0 0
  3809. 1.8678 0.8215 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  3810. 1 2 2 0
  3811. 2 3 1 0
  3812. 3 4 2 0
  3813. 4 5 1 0
  3814. 5 6 2 0
  3815. 6 1 1 0
  3816. 1 7 1 0
  3817. 2 8 1 0
  3818. 3 9 1 0
  3819. 5 10 1 0
  3820. 6 11 1 0
  3821. M END
  3822. $$$$
  3823. RDKit 3D
  3824. 11 11 0 0 0 0 0 0 0 0999 V2000
  3825. -0.2702 0.6526 0.9501 C 0 0 0 0 0 0 0 0 0 0 0 0
  3826. -1.2785 0.1186 0.1546 C 0 0 0 0 0 0 0 0 0 0 0 0
  3827. -0.9129 -0.6386 -0.9469 C 0 0 0 0 0 0 0 0 0 0 0 0
  3828. 0.3682 -0.8893 -1.2947 N 0 0 0 0 0 0 0 0 0 0 0 0
  3829. 1.3253 -0.3577 -0.5034 C 0 0 0 0 0 0 0 0 0 0 0 0
  3830. 1.0589 0.4120 0.6178 C 0 0 0 0 0 0 0 0 0 0 0 0
  3831. -0.5180 1.2514 1.8217 H 0 0 0 0 0 0 0 0 0 0 0 0
  3832. -2.3238 0.2877 0.3866 H 0 0 0 0 0 0 0 0 0 0 0 0
  3833. -1.6631 -1.0769 -1.5987 H 0 0 0 0 0 0 0 0 0 0 0 0
  3834. 2.3464 -0.5736 -0.8042 H 0 0 0 0 0 0 0 0 0 0 0 0
  3835. 1.8678 0.8139 1.2171 H 0 0 0 0 0 0 0 0 0 0 0 0
  3836. 1 2 2 0
  3837. 2 3 1 0
  3838. 3 4 2 0
  3839. 4 5 1 0
  3840. 5 6 2 0
  3841. 6 1 1 0
  3842. 1 7 1 0
  3843. 2 8 1 0
  3844. 3 9 1 0
  3845. 5 10 1 0
  3846. 6 11 1 0
  3847. M END
  3848. $$$$
  3849. RDKit 3D
  3850. 11 11 0 0 0 0 0 0 0 0999 V2000
  3851. -0.2702 0.6466 0.9542 C 0 0 0 0 0 0 0 0 0 0 0 0
  3852. -1.2785 0.1176 0.1554 C 0 0 0 0 0 0 0 0 0 0 0 0
  3853. -0.9129 -0.6326 -0.9509 C 0 0 0 0 0 0 0 0 0 0 0 0
  3854. 0.3682 -0.8812 -1.3003 N 0 0 0 0 0 0 0 0 0 0 0 0
  3855. 1.3253 -0.3545 -0.5057 C 0 0 0 0 0 0 0 0 0 0 0 0
  3856. 1.0589 0.4081 0.6204 C 0 0 0 0 0 0 0 0 0 0 0 0
  3857. -0.5180 1.2399 1.8295 H 0 0 0 0 0 0 0 0 0 0 0 0
  3858. -2.3238 0.2853 0.3884 H 0 0 0 0 0 0 0 0 0 0 0 0
  3859. -1.6631 -1.0668 -1.6054 H 0 0 0 0 0 0 0 0 0 0 0 0
  3860. 2.3464 -0.5686 -0.8077 H 0 0 0 0 0 0 0 0 0 0 0 0
  3861. 1.8678 0.8062 1.2222 H 0 0 0 0 0 0 0 0 0 0 0 0
  3862. 1 2 2 0
  3863. 2 3 1 0
  3864. 3 4 2 0
  3865. 4 5 1 0
  3866. 5 6 2 0
  3867. 6 1 1 0
  3868. 1 7 1 0
  3869. 2 8 1 0
  3870. 3 9 1 0
  3871. 5 10 1 0
  3872. 6 11 1 0
  3873. M END
  3874. $$$$
  3875. RDKit 3D
  3876. 11 11 0 0 0 0 0 0 0 0999 V2000
  3877. -0.2702 0.6406 0.9582 C 0 0 0 0 0 0 0 0 0 0 0 0
  3878. -1.2785 0.1166 0.1561 C 0 0 0 0 0 0 0 0 0 0 0 0
  3879. -0.9129 -0.6267 -0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0
  3880. 0.3682 -0.8730 -1.3058 N 0 0 0 0 0 0 0 0 0 0 0 0
  3881. 1.3253 -0.3513 -0.5079 C 0 0 0 0 0 0 0 0 0 0 0 0
  3882. 1.0589 0.4042 0.6229 C 0 0 0 0 0 0 0 0 0 0 0 0
  3883. -0.5180 1.2284 1.8373 H 0 0 0 0 0 0 0 0 0 0 0 0
  3884. -2.3238 0.2829 0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0
  3885. -1.6631 -1.0567 -1.6121 H 0 0 0 0 0 0 0 0 0 0 0 0
  3886. 2.3464 -0.5635 -0.8113 H 0 0 0 0 0 0 0 0 0 0 0 0
  3887. 1.8678 0.7985 1.2273 H 0 0 0 0 0 0 0 0 0 0 0 0
  3888. 1 2 2 0
  3889. 2 3 1 0
  3890. 3 4 2 0
  3891. 4 5 1 0
  3892. 5 6 2 0
  3893. 6 1 1 0
  3894. 1 7 1 0
  3895. 2 8 1 0
  3896. 3 9 1 0
  3897. 5 10 1 0
  3898. 6 11 1 0
  3899. M END
  3900. $$$$
  3901. RDKit 3D
  3902. 11 11 0 0 0 0 0 0 0 0999 V2000
  3903. -0.2702 0.6346 0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0
  3904. -1.2785 0.1157 0.1568 C 0 0 0 0 0 0 0 0 0 0 0 0
  3905. -0.9129 -0.6206 -0.9588 C 0 0 0 0 0 0 0 0 0 0 0 0
  3906. 0.3682 -0.8648 -1.3112 N 0 0 0 0 0 0 0 0 0 0 0 0
  3907. 1.3253 -0.3481 -0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0
  3908. 1.0589 0.4003 0.6254 C 0 0 0 0 0 0 0 0 0 0 0 0
  3909. -0.5180 1.2168 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0
  3910. -2.3238 0.2804 0.3919 H 0 0 0 0 0 0 0 0 0 0 0 0
  3911. -1.6631 -1.0466 -1.6187 H 0 0 0 0 0 0 0 0 0 0 0 0
  3912. 2.3464 -0.5584 -0.8148 H 0 0 0 0 0 0 0 0 0 0 0 0
  3913. 1.8678 0.7908 1.2323 H 0 0 0 0 0 0 0 0 0 0 0 0
  3914. 1 2 2 0
  3915. 2 3 1 0
  3916. 3 4 2 0
  3917. 4 5 1 0
  3918. 5 6 2 0
  3919. 6 1 1 0
  3920. 1 7 1 0
  3921. 2 8 1 0
  3922. 3 9 1 0
  3923. 5 10 1 0
  3924. 6 11 1 0
  3925. M END
  3926. $$$$
  3927. RDKit 3D
  3928. 11 11 0 0 0 0 0 0 0 0999 V2000
  3929. -0.2702 0.6285 0.9662 C 0 0 0 0 0 0 0 0 0 0 0 0
  3930. -1.2785 0.1147 0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0
  3931. -0.9129 -0.6146 -0.9627 C 0 0 0 0 0 0 0 0 0 0 0 0
  3932. 0.3682 -0.8565 -1.3166 N 0 0 0 0 0 0 0 0 0 0 0 0
  3933. 1.3253 -0.3449 -0.5123 C 0 0 0 0 0 0 0 0 0 0 0 0
  3934. 1.0589 0.3963 0.6279 C 0 0 0 0 0 0 0 0 0 0 0 0
  3935. -0.5180 1.2052 1.8526 H 0 0 0 0 0 0 0 0 0 0 0 0
  3936. -2.3238 0.2779 0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0
  3937. -1.6631 -1.0364 -1.6252 H 0 0 0 0 0 0 0 0 0 0 0 0
  3938. 2.3464 -0.5532 -0.8183 H 0 0 0 0 0 0 0 0 0 0 0 0
  3939. 1.8678 0.7830 1.2372 H 0 0 0 0 0 0 0 0 0 0 0 0
  3940. 1 2 2 0
  3941. 2 3 1 0
  3942. 3 4 2 0
  3943. 4 5 1 0
  3944. 5 6 2 0
  3945. 6 1 1 0
  3946. 1 7 1 0
  3947. 2 8 1 0
  3948. 3 9 1 0
  3949. 5 10 1 0
  3950. 6 11 1 0
  3951. M END
  3952. $$$$
  3953. RDKit 3D
  3954. 11 11 0 0 0 0 0 0 0 0999 V2000
  3955. -0.2702 0.6225 0.9701 C 0 0 0 0 0 0 0 0 0 0 0 0
  3956. -1.2785 0.1137 0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0
  3957. -0.9129 -0.6085 -0.9665 C 0 0 0 0 0 0 0 0 0 0 0 0
  3958. 0.3682 -0.8482 -1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0
  3959. 1.3253 -0.3417 -0.5144 C 0 0 0 0 0 0 0 0 0 0 0 0
  3960. 1.0589 0.3924 0.6304 C 0 0 0 0 0 0 0 0 0 0 0 0
  3961. -0.5180 1.1935 1.8601 H 0 0 0 0 0 0 0 0 0 0 0 0
  3962. -2.3238 0.2755 0.3954 H 0 0 0 0 0 0 0 0 0 0 0 0
  3963. -1.6631 -1.0261 -1.6317 H 0 0 0 0 0 0 0 0 0 0 0 0
  3964. 2.3464 -0.5481 -0.8218 H 0 0 0 0 0 0 0 0 0 0 0 0
  3965. 1.8678 0.7752 1.2421 H 0 0 0 0 0 0 0 0 0 0 0 0
  3966. 1 2 2 0
  3967. 2 3 1 0
  3968. 3 4 2 0
  3969. 4 5 1 0
  3970. 5 6 2 0
  3971. 6 1 1 0
  3972. 1 7 1 0
  3973. 2 8 1 0
  3974. 3 9 1 0
  3975. 5 10 1 0
  3976. 6 11 1 0
  3977. M END
  3978. $$$$
  3979. RDKit 3D
  3980. 11 11 0 0 0 0 0 0 0 0999 V2000
  3981. -0.2702 0.6164 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0
  3982. -1.2785 0.1127 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0
  3983. -0.9129 -0.6025 -0.9703 C 0 0 0 0 0 0 0 0 0 0 0 0
  3984. 0.3682 -0.8399 -1.3273 N 0 0 0 0 0 0 0 0 0 0 0 0
  3985. 1.3253 -0.3385 -0.5166 C 0 0 0 0 0 0 0 0 0 0 0 0
  3986. 1.0589 0.3884 0.6329 C 0 0 0 0 0 0 0 0 0 0 0 0
  3987. -0.5180 1.1818 1.8676 H 0 0 0 0 0 0 0 0 0 0 0 0
  3988. -2.3238 0.2730 0.3971 H 0 0 0 0 0 0 0 0 0 0 0 0
  3989. -1.6631 -1.0159 -1.6381 H 0 0 0 0 0 0 0 0 0 0 0 0
  3990. 2.3464 -0.5429 -0.8252 H 0 0 0 0 0 0 0 0 0 0 0 0
  3991. 1.8678 0.7674 1.2469 H 0 0 0 0 0 0 0 0 0 0 0 0
  3992. 1 2 2 0
  3993. 2 3 1 0
  3994. 3 4 2 0
  3995. 4 5 1 0
  3996. 5 6 2 0
  3997. 6 1 1 0
  3998. 1 7 1 0
  3999. 2 8 1 0
  4000. 3 9 1 0
  4001. 5 10 1 0
  4002. 6 11 1 0
  4003. M END
  4004. $$$$
  4005. RDKit 3D
  4006. 11 11 0 0 0 0 0 0 0 0999 V2000
  4007. -0.2702 0.6102 0.9779 C 0 0 0 0 0 0 0 0 0 0 0 0
  4008. -1.2785 0.1117 0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0
  4009. -0.9129 -0.5964 -0.9741 C 0 0 0 0 0 0 0 0 0 0 0 0
  4010. 0.3682 -0.8316 -1.3325 N 0 0 0 0 0 0 0 0 0 0 0 0
  4011. 1.3253 -0.3352 -0.5187 C 0 0 0 0 0 0 0 0 0 0 0 0
  4012. 1.0589 0.3844 0.6353 C 0 0 0 0 0 0 0 0 0 0 0 0
  4013. -0.5180 1.1701 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0
  4014. -2.3238 0.2705 0.3988 H 0 0 0 0 0 0 0 0 0 0 0 0
  4015. -1.6631 -1.0056 -1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0
  4016. 2.3464 -0.5377 -0.8286 H 0 0 0 0 0 0 0 0 0 0 0 0
  4017. 1.8678 0.7596 1.2517 H 0 0 0 0 0 0 0 0 0 0 0 0
  4018. 1 2 2 0
  4019. 2 3 1 0
  4020. 3 4 2 0
  4021. 4 5 1 0
  4022. 5 6 2 0
  4023. 6 1 1 0
  4024. 1 7 1 0
  4025. 2 8 1 0
  4026. 3 9 1 0
  4027. 5 10 1 0
  4028. 6 11 1 0
  4029. M END
  4030. $$$$
  4031. RDKit 3D
  4032. 11 11 0 0 0 0 0 0 0 0999 V2000
  4033. -0.2702 0.6041 0.9817 C 0 0 0 0 0 0 0 0 0 0 0 0
  4034. -1.2785 0.1107 0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0
  4035. -0.9129 -0.5902 -0.9778 C 0 0 0 0 0 0 0 0 0 0 0 0
  4036. 0.3682 -0.8232 -1.3377 N 0 0 0 0 0 0 0 0 0 0 0 0
  4037. 1.3253 -0.3319 -0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0
  4038. 1.0589 0.3804 0.6377 C 0 0 0 0 0 0 0 0 0 0 0 0
  4039. -0.5180 1.1583 1.8823 H 0 0 0 0 0 0 0 0 0 0 0 0
  4040. -2.3238 0.2680 0.4005 H 0 0 0 0 0 0 0 0 0 0 0 0
  4041. -1.6631 -0.9952 -1.6507 H 0 0 0 0 0 0 0 0 0 0 0 0
  4042. 2.3464 -0.5325 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0
  4043. 1.8678 0.7517 1.2565 H 0 0 0 0 0 0 0 0 0 0 0 0
  4044. 1 2 2 0
  4045. 2 3 1 0
  4046. 3 4 2 0
  4047. 4 5 1 0
  4048. 5 6 2 0
  4049. 6 1 1 0
  4050. 1 7 1 0
  4051. 2 8 1 0
  4052. 3 9 1 0
  4053. 5 10 1 0
  4054. 6 11 1 0
  4055. M END
  4056. $$$$
  4057. RDKit 3D
  4058. 11 11 0 0 0 0 0 0 0 0999 V2000
  4059. -0.2702 0.5979 0.9855 C 0 0 0 0 0 0 0 0 0 0 0 0
  4060. -1.2785 0.1097 0.1611 C 0 0 0 0 0 0 0 0 0 0 0 0
  4061. -0.9129 -0.5841 -0.9815 C 0 0 0 0 0 0 0 0 0 0 0 0
  4062. 0.3682 -0.8148 -1.3429 N 0 0 0 0 0 0 0 0 0 0 0 0
  4063. 1.3253 -0.3287 -0.5228 C 0 0 0 0 0 0 0 0 0 0 0 0
  4064. 1.0589 0.3764 0.6401 C 0 0 0 0 0 0 0 0 0 0 0 0
  4065. -0.5180 1.1464 1.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
  4066. -2.3238 0.2654 0.4022 H 0 0 0 0 0 0 0 0 0 0 0 0
  4067. -1.6631 -0.9848 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0
  4068. 2.3464 -0.5273 -0.8353 H 0 0 0 0 0 0 0 0 0 0 0 0
  4069. 1.8678 0.7438 1.2612 H 0 0 0 0 0 0 0 0 0 0 0 0
  4070. 1 2 2 0
  4071. 2 3 1 0
  4072. 3 4 2 0
  4073. 4 5 1 0
  4074. 5 6 2 0
  4075. 6 1 1 0
  4076. 1 7 1 0
  4077. 2 8 1 0
  4078. 3 9 1 0
  4079. 5 10 1 0
  4080. 6 11 1 0
  4081. M END
  4082. $$$$
  4083. RDKit 3D
  4084. 11 11 0 0 0 0 0 0 0 0999 V2000
  4085. -0.2702 0.5917 0.9892 C 0 0 0 0 0 0 0 0 0 0 0 0
  4086. -1.2785 0.1086 0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0
  4087. -0.9129 -0.5779 -0.9852 C 0 0 0 0 0 0 0 0 0 0 0 0
  4088. 0.3682 -0.8063 -1.3480 N 0 0 0 0 0 0 0 0 0 0 0 0
  4089. 1.3253 -0.3254 -0.5249 C 0 0 0 0 0 0 0 0 0 0 0 0
  4090. 1.0589 0.3724 0.6424 C 0 0 0 0 0 0 0 0 0 0 0 0
  4091. -0.5180 1.1345 1.8967 H 0 0 0 0 0 0 0 0 0 0 0 0
  4092. -2.3238 0.2629 0.4039 H 0 0 0 0 0 0 0 0 0 0 0 0
  4093. -1.6631 -0.9744 -1.6631 H 0 0 0 0 0 0 0 0 0 0 0 0
  4094. 2.3464 -0.5220 -0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0
  4095. 1.8678 0.7358 1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0
  4096. 1 2 2 0
  4097. 2 3 1 0
  4098. 3 4 2 0
  4099. 4 5 1 0
  4100. 5 6 2 0
  4101. 6 1 1 0
  4102. 1 7 1 0
  4103. 2 8 1 0
  4104. 3 9 1 0
  4105. 5 10 1 0
  4106. 6 11 1 0
  4107. M END
  4108. $$$$
  4109. RDKit 3D
  4110. 11 11 0 0 0 0 0 0 0 0999 V2000
  4111. -0.2702 0.5855 0.9929 C 0 0 0 0 0 0 0 0 0 0 0 0
  4112. -1.2785 0.1076 0.1624 C 0 0 0 0 0 0 0 0 0 0 0 0
  4113. -0.9129 -0.5717 -0.9888 C 0 0 0 0 0 0 0 0 0 0 0 0
  4114. 0.3682 -0.7978 -1.3530 N 0 0 0 0 0 0 0 0 0 0 0 0
  4115. 1.3253 -0.3221 -0.5269 C 0 0 0 0 0 0 0 0 0 0 0 0
  4116. 1.0589 0.3683 0.6448 C 0 0 0 0 0 0 0 0 0 0 0 0
  4117. -0.5180 1.1226 1.9038 H 0 0 0 0 0 0 0 0 0 0 0 0
  4118. -2.3238 0.2604 0.4055 H 0 0 0 0 0 0 0 0 0 0 0 0
  4119. -1.6631 -0.9639 -1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0
  4120. 2.3464 -0.5167 -0.8418 H 0 0 0 0 0 0 0 0 0 0 0 0
  4121. 1.8678 0.7279 1.2704 H 0 0 0 0 0 0 0 0 0 0 0 0
  4122. 1 2 2 0
  4123. 2 3 1 0
  4124. 3 4 2 0
  4125. 4 5 1 0
  4126. 5 6 2 0
  4127. 6 1 1 0
  4128. 1 7 1 0
  4129. 2 8 1 0
  4130. 3 9 1 0
  4131. 5 10 1 0
  4132. 6 11 1 0
  4133. M END
  4134. $$$$
  4135. RDKit 3D
  4136. 11 11 0 0 0 0 0 0 0 0999 V2000
  4137. -0.2702 0.5792 0.9965 C 0 0 0 0 0 0 0 0 0 0 0 0
  4138. -1.2785 0.1066 0.1631 C 0 0 0 0 0 0 0 0 0 0 0 0
  4139. -0.9129 -0.5655 -0.9924 C 0 0 0 0 0 0 0 0 0 0 0 0
  4140. 0.3682 -0.7893 -1.3580 N 0 0 0 0 0 0 0 0 0 0 0 0
  4141. 1.3253 -0.3187 -0.5289 C 0 0 0 0 0 0 0 0 0 0 0 0
  4142. 1.0589 0.3643 0.6471 C 0 0 0 0 0 0 0 0 0 0 0 0
  4143. -0.5180 1.1106 1.9108 H 0 0 0 0 0 0 0 0 0 0 0 0
  4144. -2.3238 0.2578 0.4071 H 0 0 0 0 0 0 0 0 0 0 0 0
  4145. -1.6631 -0.9534 -1.6752 H 0 0 0 0 0 0 0 0 0 0 0 0
  4146. 2.3464 -0.5114 -0.8451 H 0 0 0 0 0 0 0 0 0 0 0 0
  4147. 1.8678 0.7199 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  4148. 1 2 2 0
  4149. 2 3 1 0
  4150. 3 4 2 0
  4151. 4 5 1 0
  4152. 5 6 2 0
  4153. 6 1 1 0
  4154. 1 7 1 0
  4155. 2 8 1 0
  4156. 3 9 1 0
  4157. 5 10 1 0
  4158. 6 11 1 0
  4159. M END
  4160. $$$$
  4161. RDKit 3D
  4162. 11 11 0 0 0 0 0 0 0 0999 V2000
  4163. -0.2702 0.5729 1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
  4164. -1.2785 0.1056 0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0
  4165. -0.9129 -0.5592 -0.9959 C 0 0 0 0 0 0 0 0 0 0 0 0
  4166. 0.3682 -0.7807 -1.3629 N 0 0 0 0 0 0 0 0 0 0 0 0
  4167. 1.3253 -0.3154 -0.5309 C 0 0 0 0 0 0 0 0 0 0 0 0
  4168. 1.0589 0.3602 0.6493 C 0 0 0 0 0 0 0 0 0 0 0 0
  4169. -0.5180 1.0986 1.9177 H 0 0 0 0 0 0 0 0 0 0 0 0
  4170. -2.3238 0.2552 0.4088 H 0 0 0 0 0 0 0 0 0 0 0 0
  4171. -1.6631 -0.9429 -1.6812 H 0 0 0 0 0 0 0 0 0 0 0 0
  4172. 2.3464 -0.5061 -0.8483 H 0 0 0 0 0 0 0 0 0 0 0 0
  4173. 1.8678 0.7118 1.2795 H 0 0 0 0 0 0 0 0 0 0 0 0
  4174. 1 2 2 0
  4175. 2 3 1 0
  4176. 3 4 2 0
  4177. 4 5 1 0
  4178. 5 6 2 0
  4179. 6 1 1 0
  4180. 1 7 1 0
  4181. 2 8 1 0
  4182. 3 9 1 0
  4183. 5 10 1 0
  4184. 6 11 1 0
  4185. M END
  4186. $$$$
  4187. RDKit 3D
  4188. 11 11 0 0 0 0 0 0 0 0999 V2000
  4189. -0.2702 0.5666 1.0037 C 0 0 0 0 0 0 0 0 0 0 0 0
  4190. -1.2785 0.1045 0.1644 C 0 0 0 0 0 0 0 0 0 0 0 0
  4191. -0.9129 -0.5529 -0.9994 C 0 0 0 0 0 0 0 0 0 0 0 0
  4192. 0.3682 -0.7722 -1.3678 N 0 0 0 0 0 0 0 0 0 0 0 0
  4193. 1.3253 -0.3121 -0.5329 C 0 0 0 0 0 0 0 0 0 0 0 0
  4194. 1.0589 0.3561 0.6516 C 0 0 0 0 0 0 0 0 0 0 0 0
  4195. -0.5180 1.0865 1.9246 H 0 0 0 0 0 0 0 0 0 0 0 0
  4196. -2.3238 0.2527 0.4103 H 0 0 0 0 0 0 0 0 0 0 0 0
  4197. -1.6631 -0.9323 -1.6871 H 0 0 0 0 0 0 0 0 0 0 0 0
  4198. 2.3464 -0.5008 -0.8514 H 0 0 0 0 0 0 0 0 0 0 0 0
  4199. 1.8678 0.7038 1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0
  4200. 1 2 2 0
  4201. 2 3 1 0
  4202. 3 4 2 0
  4203. 4 5 1 0
  4204. 5 6 2 0
  4205. 6 1 1 0
  4206. 1 7 1 0
  4207. 2 8 1 0
  4208. 3 9 1 0
  4209. 5 10 1 0
  4210. 6 11 1 0
  4211. M END
  4212. $$$$
  4213. RDKit 3D
  4214. 11 11 0 0 0 0 0 0 0 0999 V2000
  4215. -0.2702 0.5603 1.0073 C 0 0 0 0 0 0 0 0 0 0 0 0
  4216. -1.2785 0.1035 0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0
  4217. -0.9129 -0.5467 -1.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
  4218. 0.3682 -0.7636 -1.3726 N 0 0 0 0 0 0 0 0 0 0 0 0
  4219. 1.3253 -0.3087 -0.5349 C 0 0 0 0 0 0 0 0 0 0 0 0
  4220. 1.0589 0.3520 0.6538 C 0 0 0 0 0 0 0 0 0 0 0 0
  4221. -0.5180 1.0744 1.9314 H 0 0 0 0 0 0 0 0 0 0 0 0
  4222. -2.3238 0.2501 0.4119 H 0 0 0 0 0 0 0 0 0 0 0 0
  4223. -1.6631 -0.9217 -1.6929 H 0 0 0 0 0 0 0 0 0 0 0 0
  4224. 2.3464 -0.4954 -0.8546 H 0 0 0 0 0 0 0 0 0 0 0 0
  4225. 1.8678 0.6957 1.2883 H 0 0 0 0 0 0 0 0 0 0 0 0
  4226. 1 2 2 0
  4227. 2 3 1 0
  4228. 3 4 2 0
  4229. 4 5 1 0
  4230. 5 6 2 0
  4231. 6 1 1 0
  4232. 1 7 1 0
  4233. 2 8 1 0
  4234. 3 9 1 0
  4235. 5 10 1 0
  4236. 6 11 1 0
  4237. M END
  4238. $$$$
  4239. RDKit 3D
  4240. 11 11 0 0 0 0 0 0 0 0999 V2000
  4241. -0.2702 0.5540 1.0108 C 0 0 0 0 0 0 0 0 0 0 0 0
  4242. -1.2785 0.1025 0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0
  4243. -0.9129 -0.5403 -1.0063 C 0 0 0 0 0 0 0 0 0 0 0 0
  4244. 0.3682 -0.7549 -1.3774 N 0 0 0 0 0 0 0 0 0 0 0 0
  4245. 1.3253 -0.3053 -0.5368 C 0 0 0 0 0 0 0 0 0 0 0 0
  4246. 1.0589 0.3479 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0
  4247. -0.5180 1.0622 1.9381 H 0 0 0 0 0 0 0 0 0 0 0 0
  4248. -2.3238 0.2475 0.4135 H 0 0 0 0 0 0 0 0 0 0 0 0
  4249. -1.6631 -0.9110 -1.6987 H 0 0 0 0 0 0 0 0 0 0 0 0
  4250. 2.3464 -0.4900 -0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0
  4251. 1.8678 0.6876 1.2927 H 0 0 0 0 0 0 0 0 0 0 0 0
  4252. 1 2 2 0
  4253. 2 3 1 0
  4254. 3 4 2 0
  4255. 4 5 1 0
  4256. 5 6 2 0
  4257. 6 1 1 0
  4258. 1 7 1 0
  4259. 2 8 1 0
  4260. 3 9 1 0
  4261. 5 10 1 0
  4262. 6 11 1 0
  4263. M END
  4264. $$$$
  4265. RDKit 3D
  4266. 11 11 0 0 0 0 0 0 0 0999 V2000
  4267. -0.2702 0.5476 1.0142 C 0 0 0 0 0 0 0 0 0 0 0 0
  4268. -1.2785 0.1014 0.1664 C 0 0 0 0 0 0 0 0 0 0 0 0
  4269. -0.9129 -0.5340 -1.0096 C 0 0 0 0 0 0 0 0 0 0 0 0
  4270. 0.3682 -0.7462 -1.3821 N 0 0 0 0 0 0 0 0 0 0 0 0
  4271. 1.3253 -0.3020 -0.5387 C 0 0 0 0 0 0 0 0 0 0 0 0
  4272. 1.0589 0.3438 0.6582 C 0 0 0 0 0 0 0 0 0 0 0 0
  4273. -0.5180 1.0500 1.9447 H 0 0 0 0 0 0 0 0 0 0 0 0
  4274. -2.3238 0.2449 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0
  4275. -1.6631 -0.9003 -1.7044 H 0 0 0 0 0 0 0 0 0 0 0 0
  4276. 2.3464 -0.4846 -0.8607 H 0 0 0 0 0 0 0 0 0 0 0 0
  4277. 1.8678 0.6795 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  4278. 1 2 2 0
  4279. 2 3 1 0
  4280. 3 4 2 0
  4281. 4 5 1 0
  4282. 5 6 2 0
  4283. 6 1 1 0
  4284. 1 7 1 0
  4285. 2 8 1 0
  4286. 3 9 1 0
  4287. 5 10 1 0
  4288. 6 11 1 0
  4289. M END
  4290. $$$$
  4291. RDKit 3D
  4292. 11 11 0 0 0 0 0 0 0 0999 V2000
  4293. -0.2702 0.5412 1.0177 C 0 0 0 0 0 0 0 0 0 0 0 0
  4294. -1.2785 0.1004 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0
  4295. -0.9129 -0.5277 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0
  4296. 0.3682 -0.7376 -1.3868 N 0 0 0 0 0 0 0 0 0 0 0 0
  4297. 1.3253 -0.2986 -0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0
  4298. 1.0589 0.3396 0.6603 C 0 0 0 0 0 0 0 0 0 0 0 0
  4299. -0.5180 1.0378 1.9513 H 0 0 0 0 0 0 0 0 0 0 0 0
  4300. -2.3238 0.2423 0.4166 H 0 0 0 0 0 0 0 0 0 0 0 0
  4301. -1.6631 -0.8896 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0
  4302. 2.3464 -0.4792 -0.8638 H 0 0 0 0 0 0 0 0 0 0 0 0
  4303. 1.8678 0.6713 1.3012 H 0 0 0 0 0 0 0 0 0 0 0 0
  4304. 1 2 2 0
  4305. 2 3 1 0
  4306. 3 4 2 0
  4307. 4 5 1 0
  4308. 5 6 2 0
  4309. 6 1 1 0
  4310. 1 7 1 0
  4311. 2 8 1 0
  4312. 3 9 1 0
  4313. 5 10 1 0
  4314. 6 11 1 0
  4315. M END
  4316. $$$$
  4317. RDKit 3D
  4318. 11 11 0 0 0 0 0 0 0 0999 V2000
  4319. -0.2702 0.5348 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
  4320. -1.2785 0.0993 0.1676 C 0 0 0 0 0 0 0 0 0 0 0 0
  4321. -0.9129 -0.5213 -1.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
  4322. 0.3682 -0.7288 -1.3914 N 0 0 0 0 0 0 0 0 0 0 0 0
  4323. 1.3253 -0.2952 -0.5424 C 0 0 0 0 0 0 0 0 0 0 0 0
  4324. 1.0589 0.3355 0.6624 C 0 0 0 0 0 0 0 0 0 0 0 0
  4325. -0.5180 1.0255 1.9578 H 0 0 0 0 0 0 0 0 0 0 0 0
  4326. -2.3238 0.2397 0.4181 H 0 0 0 0 0 0 0 0 0 0 0 0
  4327. -1.6631 -0.8788 -1.7155 H 0 0 0 0 0 0 0 0 0 0 0 0
  4328. 2.3464 -0.4738 -0.8667 H 0 0 0 0 0 0 0 0 0 0 0 0
  4329. 1.8678 0.6631 1.3054 H 0 0 0 0 0 0 0 0 0 0 0 0
  4330. 1 2 2 0
  4331. 2 3 1 0
  4332. 3 4 2 0
  4333. 4 5 1 0
  4334. 5 6 2 0
  4335. 6 1 1 0
  4336. 1 7 1 0
  4337. 2 8 1 0
  4338. 3 9 1 0
  4339. 5 10 1 0
  4340. 6 11 1 0
  4341. M END
  4342. $$$$
  4343. RDKit 3D
  4344. 11 11 0 0 0 0 0 0 0 0999 V2000
  4345. -0.2702 0.5284 1.0244 C 0 0 0 0 0 0 0 0 0 0 0 0
  4346. -1.2785 0.0983 0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
  4347. -0.9129 -0.5149 -1.0195 C 0 0 0 0 0 0 0 0 0 0 0 0
  4348. 0.3682 -0.7201 -1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0
  4349. 1.3253 -0.2918 -0.5443 C 0 0 0 0 0 0 0 0 0 0 0 0
  4350. 1.0589 0.3313 0.6645 C 0 0 0 0 0 0 0 0 0 0 0 0
  4351. -0.5180 1.0132 1.9642 H 0 0 0 0 0 0 0 0 0 0 0 0
  4352. -2.3238 0.2370 0.4196 H 0 0 0 0 0 0 0 0 0 0 0 0
  4353. -1.6631 -0.8680 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0
  4354. 2.3464 -0.4683 -0.8697 H 0 0 0 0 0 0 0 0 0 0 0 0
  4355. 1.8678 0.6549 1.3095 H 0 0 0 0 0 0 0 0 0 0 0 0
  4356. 1 2 2 0
  4357. 2 3 1 0
  4358. 3 4 2 0
  4359. 4 5 1 0
  4360. 5 6 2 0
  4361. 6 1 1 0
  4362. 1 7 1 0
  4363. 2 8 1 0
  4364. 3 9 1 0
  4365. 5 10 1 0
  4366. 6 11 1 0
  4367. M END
  4368. $$$$
  4369. RDKit 3D
  4370. 11 11 0 0 0 0 0 0 0 0999 V2000
  4371. -0.2702 0.5220 1.0277 C 0 0 0 0 0 0 0 0 0 0 0 0
  4372. -1.2785 0.0972 0.1689 C 0 0 0 0 0 0 0 0 0 0 0 0
  4373. -0.9129 -0.5085 -1.0227 C 0 0 0 0 0 0 0 0 0 0 0 0
  4374. 0.3682 -0.7113 -1.4005 N 0 0 0 0 0 0 0 0 0 0 0 0
  4375. 1.3253 -0.2883 -0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0
  4376. 1.0589 0.3271 0.6666 C 0 0 0 0 0 0 0 0 0 0 0 0
  4377. -0.5180 1.0008 1.9705 H 0 0 0 0 0 0 0 0 0 0 0 0
  4378. -2.3238 0.2344 0.4211 H 0 0 0 0 0 0 0 0 0 0 0 0
  4379. -1.6631 -0.8572 -1.7264 H 0 0 0 0 0 0 0 0 0 0 0 0
  4380. 2.3464 -0.4629 -0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0
  4381. 1.8678 0.6467 1.3136 H 0 0 0 0 0 0 0 0 0 0 0 0
  4382. 1 2 2 0
  4383. 2 3 1 0
  4384. 3 4 2 0
  4385. 4 5 1 0
  4386. 5 6 2 0
  4387. 6 1 1 0
  4388. 1 7 1 0
  4389. 2 8 1 0
  4390. 3 9 1 0
  4391. 5 10 1 0
  4392. 6 11 1 0
  4393. M END
  4394. $$$$
  4395. RDKit 3D
  4396. 11 11 0 0 0 0 0 0 0 0999 V2000
  4397. -0.2702 0.5155 1.0309 C 0 0 0 0 0 0 0 0 0 0 0 0
  4398. -1.2785 0.0962 0.1695 C 0 0 0 0 0 0 0 0 0 0 0 0
  4399. -0.9129 -0.5020 -1.0259 C 0 0 0 0 0 0 0 0 0 0 0 0
  4400. 0.3682 -0.7025 -1.4049 N 0 0 0 0 0 0 0 0 0 0 0 0
  4401. 1.3253 -0.2849 -0.5479 C 0 0 0 0 0 0 0 0 0 0 0 0
  4402. 1.0589 0.3229 0.6687 C 0 0 0 0 0 0 0 0 0 0 0 0
  4403. -0.5180 0.9884 1.9768 H 0 0 0 0 0 0 0 0 0 0 0 0
  4404. -2.3238 0.2317 0.4225 H 0 0 0 0 0 0 0 0 0 0 0 0
  4405. -1.6631 -0.8463 -1.7318 H 0 0 0 0 0 0 0 0 0 0 0 0
  4406. 2.3464 -0.4574 -0.8755 H 0 0 0 0 0 0 0 0 0 0 0 0
  4407. 1.8678 0.6384 1.3177 H 0 0 0 0 0 0 0 0 0 0 0 0
  4408. 1 2 2 0
  4409. 2 3 1 0
  4410. 3 4 2 0
  4411. 4 5 1 0
  4412. 5 6 2 0
  4413. 6 1 1 0
  4414. 1 7 1 0
  4415. 2 8 1 0
  4416. 3 9 1 0
  4417. 5 10 1 0
  4418. 6 11 1 0
  4419. M END
  4420. $$$$
  4421. RDKit 3D
  4422. 11 11 0 0 0 0 0 0 0 0999 V2000
  4423. -0.2702 0.5090 1.0342 C 0 0 0 0 0 0 0 0 0 0 0 0
  4424. -1.2785 0.0951 0.1701 C 0 0 0 0 0 0 0 0 0 0 0 0
  4425. -0.9129 -0.4956 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  4426. 0.3682 -0.6936 -1.4093 N 0 0 0 0 0 0 0 0 0 0 0 0
  4427. 1.3253 -0.2815 -0.5497 C 0 0 0 0 0 0 0 0 0 0 0 0
  4428. 1.0589 0.3187 0.6707 C 0 0 0 0 0 0 0 0 0 0 0 0
  4429. -0.5180 0.9760 1.9829 H 0 0 0 0 0 0 0 0 0 0 0 0
  4430. -2.3238 0.2291 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  4431. -1.6631 -0.8354 -1.7371 H 0 0 0 0 0 0 0 0 0 0 0 0
  4432. 2.3464 -0.4519 -0.8784 H 0 0 0 0 0 0 0 0 0 0 0 0
  4433. 1.8678 0.6301 1.3217 H 0 0 0 0 0 0 0 0 0 0 0 0
  4434. 1 2 2 0
  4435. 2 3 1 0
  4436. 3 4 2 0
  4437. 4 5 1 0
  4438. 5 6 2 0
  4439. 6 1 1 0
  4440. 1 7 1 0
  4441. 2 8 1 0
  4442. 3 9 1 0
  4443. 5 10 1 0
  4444. 6 11 1 0
  4445. M END
  4446. $$$$
  4447. RDKit 3D
  4448. 11 11 0 0 0 0 0 0 0 0999 V2000
  4449. -0.2702 0.5025 1.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
  4450. -1.2785 0.0940 0.1707 C 0 0 0 0 0 0 0 0 0 0 0 0
  4451. -0.9129 -0.4891 -1.0321 C 0 0 0 0 0 0 0 0 0 0 0 0
  4452. 0.3682 -0.6848 -1.4136 N 0 0 0 0 0 0 0 0 0 0 0 0
  4453. 1.3253 -0.2780 -0.5515 C 0 0 0 0 0 0 0 0 0 0 0 0
  4454. 1.0589 0.3145 0.6727 C 0 0 0 0 0 0 0 0 0 0 0 0
  4455. -0.5180 0.9635 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0
  4456. -2.3238 0.2264 0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0
  4457. -1.6631 -0.8245 -1.7423 H 0 0 0 0 0 0 0 0 0 0 0 0
  4458. 2.3464 -0.4463 -0.8812 H 0 0 0 0 0 0 0 0 0 0 0 0
  4459. 1.8678 0.6218 1.3256 H 0 0 0 0 0 0 0 0 0 0 0 0
  4460. 1 2 2 0
  4461. 2 3 1 0
  4462. 3 4 2 0
  4463. 4 5 1 0
  4464. 5 6 2 0
  4465. 6 1 1 0
  4466. 1 7 1 0
  4467. 2 8 1 0
  4468. 3 9 1 0
  4469. 5 10 1 0
  4470. 6 11 1 0
  4471. M END
  4472. $$$$
  4473. RDKit 3D
  4474. 11 11 0 0 0 0 0 0 0 0999 V2000
  4475. -0.2702 0.4960 1.0405 C 0 0 0 0 0 0 0 0 0 0 0 0
  4476. -1.2785 0.0929 0.1713 C 0 0 0 0 0 0 0 0 0 0 0 0
  4477. -0.9129 -0.4826 -1.0352 C 0 0 0 0 0 0 0 0 0 0 0 0
  4478. 0.3682 -0.6759 -1.4179 N 0 0 0 0 0 0 0 0 0 0 0 0
  4479. 1.3253 -0.2745 -0.5532 C 0 0 0 0 0 0 0 0 0 0 0 0
  4480. 1.0589 0.3103 0.6746 C 0 0 0 0 0 0 0 0 0 0 0 0
  4481. -0.5180 0.9510 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
  4482. -2.3238 0.2237 0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0
  4483. -1.6631 -0.8135 -1.7474 H 0 0 0 0 0 0 0 0 0 0 0 0
  4484. 2.3464 -0.4408 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  4485. 1.8678 0.6134 1.3295 H 0 0 0 0 0 0 0 0 0 0 0 0
  4486. 1 2 2 0
  4487. 2 3 1 0
  4488. 3 4 2 0
  4489. 4 5 1 0
  4490. 5 6 2 0
  4491. 6 1 1 0
  4492. 1 7 1 0
  4493. 2 8 1 0
  4494. 3 9 1 0
  4495. 5 10 1 0
  4496. 6 11 1 0
  4497. M END
  4498. $$$$
  4499. RDKit 3D
  4500. 11 11 0 0 0 0 0 0 0 0999 V2000
  4501. -0.2702 0.4894 1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0
  4502. -1.2785 0.0919 0.1718 C 0 0 0 0 0 0 0 0 0 0 0 0
  4503. -0.9129 -0.4761 -1.0382 C 0 0 0 0 0 0 0 0 0 0 0 0
  4504. 0.3682 -0.6669 -1.4221 N 0 0 0 0 0 0 0 0 0 0 0 0
  4505. 1.3253 -0.2710 -0.5549 C 0 0 0 0 0 0 0 0 0 0 0 0
  4506. 1.0589 0.3060 0.6766 C 0 0 0 0 0 0 0 0 0 0 0 0
  4507. -0.5180 0.9384 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  4508. -2.3238 0.2210 0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0
  4509. -1.6631 -0.8026 -1.7525 H 0 0 0 0 0 0 0 0 0 0 0 0
  4510. 2.3464 -0.4352 -0.8867 H 0 0 0 0 0 0 0 0 0 0 0 0
  4511. 1.8678 0.6051 1.3333 H 0 0 0 0 0 0 0 0 0 0 0 0
  4512. 1 2 2 0
  4513. 2 3 1 0
  4514. 3 4 2 0
  4515. 4 5 1 0
  4516. 5 6 2 0
  4517. 6 1 1 0
  4518. 1 7 1 0
  4519. 2 8 1 0
  4520. 3 9 1 0
  4521. 5 10 1 0
  4522. 6 11 1 0
  4523. M END
  4524. $$$$
  4525. RDKit 3D
  4526. 11 11 0 0 0 0 0 0 0 0999 V2000
  4527. -0.2702 0.4829 1.0466 C 0 0 0 0 0 0 0 0 0 0 0 0
  4528. -1.2785 0.0908 0.1724 C 0 0 0 0 0 0 0 0 0 0 0 0
  4529. -0.9129 -0.4696 -1.0412 C 0 0 0 0 0 0 0 0 0 0 0 0
  4530. 0.3682 -0.6580 -1.4263 N 0 0 0 0 0 0 0 0 0 0 0 0
  4531. 1.3253 -0.2675 -0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0
  4532. 1.0589 0.3018 0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0
  4533. -0.5180 0.9258 2.0068 H 0 0 0 0 0 0 0 0 0 0 0 0
  4534. -2.3238 0.2184 0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0
  4535. -1.6631 -0.7915 -1.7575 H 0 0 0 0 0 0 0 0 0 0 0 0
  4536. 2.3464 -0.4296 -0.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
  4537. 1.8678 0.5967 1.3371 H 0 0 0 0 0 0 0 0 0 0 0 0
  4538. 1 2 2 0
  4539. 2 3 1 0
  4540. 3 4 2 0
  4541. 4 5 1 0
  4542. 5 6 2 0
  4543. 6 1 1 0
  4544. 1 7 1 0
  4545. 2 8 1 0
  4546. 3 9 1 0
  4547. 5 10 1 0
  4548. 6 11 1 0
  4549. M END
  4550. $$$$
  4551. RDKit 3D
  4552. 11 11 0 0 0 0 0 0 0 0999 V2000
  4553. -0.2702 0.4763 1.0496 C 0 0 0 0 0 0 0 0 0 0 0 0
  4554. -1.2785 0.0897 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0
  4555. -0.9129 -0.4630 -1.0441 C 0 0 0 0 0 0 0 0 0 0 0 0
  4556. 0.3682 -0.6490 -1.4304 N 0 0 0 0 0 0 0 0 0 0 0 0
  4557. 1.3253 -0.2640 -0.5583 C 0 0 0 0 0 0 0 0 0 0 0 0
  4558. 1.0589 0.2975 0.6803 C 0 0 0 0 0 0 0 0 0 0 0 0
  4559. -0.5180 0.9132 2.0126 H 0 0 0 0 0 0 0 0 0 0 0 0
  4560. -2.3238 0.2156 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0
  4561. -1.6631 -0.7805 -1.7625 H 0 0 0 0 0 0 0 0 0 0 0 0
  4562. 2.3464 -0.4240 -0.8921 H 0 0 0 0 0 0 0 0 0 0 0 0
  4563. 1.8678 0.5883 1.3408 H 0 0 0 0 0 0 0 0 0 0 0 0
  4564. 1 2 2 0
  4565. 2 3 1 0
  4566. 3 4 2 0
  4567. 4 5 1 0
  4568. 5 6 2 0
  4569. 6 1 1 0
  4570. 1 7 1 0
  4571. 2 8 1 0
  4572. 3 9 1 0
  4573. 5 10 1 0
  4574. 6 11 1 0
  4575. M END
  4576. $$$$
  4577. RDKit 3D
  4578. 11 11 0 0 0 0 0 0 0 0999 V2000
  4579. -0.2702 0.4697 1.0526 C 0 0 0 0 0 0 0 0 0 0 0 0
  4580. -1.2785 0.0886 0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0
  4581. -0.9129 -0.4564 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0
  4582. 0.3682 -0.6400 -1.4344 N 0 0 0 0 0 0 0 0 0 0 0 0
  4583. 1.3253 -0.2605 -0.5599 C 0 0 0 0 0 0 0 0 0 0 0 0
  4584. 1.0589 0.2932 0.6822 C 0 0 0 0 0 0 0 0 0 0 0 0
  4585. -0.5180 0.9005 2.0183 H 0 0 0 0 0 0 0 0 0 0 0 0
  4586. -2.3238 0.2129 0.4323 H 0 0 0 0 0 0 0 0 0 0 0 0
  4587. -1.6631 -0.7694 -1.7673 H 0 0 0 0 0 0 0 0 0 0 0 0
  4588. 2.3464 -0.4184 -0.8948 H 0 0 0 0 0 0 0 0 0 0 0 0
  4589. 1.8678 0.5798 1.3445 H 0 0 0 0 0 0 0 0 0 0 0 0
  4590. 1 2 2 0
  4591. 2 3 1 0
  4592. 3 4 2 0
  4593. 4 5 1 0
  4594. 5 6 2 0
  4595. 6 1 1 0
  4596. 1 7 1 0
  4597. 2 8 1 0
  4598. 3 9 1 0
  4599. 5 10 1 0
  4600. 6 11 1 0
  4601. M END
  4602. $$$$
  4603. RDKit 3D
  4604. 11 11 0 0 0 0 0 0 0 0999 V2000
  4605. -0.2702 0.4630 1.0555 C 0 0 0 0 0 0 0 0 0 0 0 0
  4606. -1.2785 0.0875 0.1741 C 0 0 0 0 0 0 0 0 0 0 0 0
  4607. -0.9129 -0.4499 -1.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
  4608. 0.3682 -0.6310 -1.4384 N 0 0 0 0 0 0 0 0 0 0 0 0
  4609. 1.3253 -0.2570 -0.5615 C 0 0 0 0 0 0 0 0 0 0 0 0
  4610. 1.0589 0.2889 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0
  4611. -0.5180 0.8878 2.0239 H 0 0 0 0 0 0 0 0 0 0 0 0
  4612. -2.3238 0.2102 0.4336 H 0 0 0 0 0 0 0 0 0 0 0 0
  4613. -1.6631 -0.7583 -1.7721 H 0 0 0 0 0 0 0 0 0 0 0 0
  4614. 2.3464 -0.4128 -0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0
  4615. 1.8678 0.5714 1.3481 H 0 0 0 0 0 0 0 0 0 0 0 0
  4616. 1 2 2 0
  4617. 2 3 1 0
  4618. 3 4 2 0
  4619. 4 5 1 0
  4620. 5 6 2 0
  4621. 6 1 1 0
  4622. 1 7 1 0
  4623. 2 8 1 0
  4624. 3 9 1 0
  4625. 5 10 1 0
  4626. 6 11 1 0
  4627. M END
  4628. $$$$
  4629. RDKit 3D
  4630. 11 11 0 0 0 0 0 0 0 0999 V2000
  4631. -0.2702 0.4564 1.0584 C 0 0 0 0 0 0 0 0 0 0 0 0
  4632. -1.2785 0.0864 0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
  4633. -0.9129 -0.4433 -1.0526 C 0 0 0 0 0 0 0 0 0 0 0 0
  4634. 0.3682 -0.6219 -1.4423 N 0 0 0 0 0 0 0 0 0 0 0 0
  4635. 1.3253 -0.2535 -0.5631 C 0 0 0 0 0 0 0 0 0 0 0 0
  4636. 1.0589 0.2846 0.6858 C 0 0 0 0 0 0 0 0 0 0 0 0
  4637. -0.5180 0.8751 2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0
  4638. -2.3238 0.2075 0.4349 H 0 0 0 0 0 0 0 0 0 0 0 0
  4639. -1.6631 -0.7471 -1.7769 H 0 0 0 0 0 0 0 0 0 0 0 0
  4640. 2.3464 -0.4071 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4641. 1.8678 0.5629 1.3516 H 0 0 0 0 0 0 0 0 0 0 0 0
  4642. 1 2 2 0
  4643. 2 3 1 0
  4644. 3 4 2 0
  4645. 4 5 1 0
  4646. 5 6 2 0
  4647. 6 1 1 0
  4648. 1 7 1 0
  4649. 2 8 1 0
  4650. 3 9 1 0
  4651. 5 10 1 0
  4652. 6 11 1 0
  4653. M END
  4654. $$$$
  4655. RDKit 3D
  4656. 11 11 0 0 0 0 0 0 0 0999 V2000
  4657. -0.2702 0.4497 1.0613 C 0 0 0 0 0 0 0 0 0 0 0 0
  4658. -1.2785 0.0853 0.1752 C 0 0 0 0 0 0 0 0 0 0 0 0
  4659. -0.9129 -0.4366 -1.0554 C 0 0 0 0 0 0 0 0 0 0 0 0
  4660. 0.3682 -0.6129 -1.4462 N 0 0 0 0 0 0 0 0 0 0 0 0
  4661. 1.3253 -0.2499 -0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0
  4662. 1.0589 0.2803 0.6876 C 0 0 0 0 0 0 0 0 0 0 0 0
  4663. -0.5180 0.8623 2.0349 H 0 0 0 0 0 0 0 0 0 0 0 0
  4664. -2.3238 0.2048 0.4362 H 0 0 0 0 0 0 0 0 0 0 0 0
  4665. -1.6631 -0.7359 -1.7815 H 0 0 0 0 0 0 0 0 0 0 0 0
  4666. 2.3464 -0.4015 -0.9025 H 0 0 0 0 0 0 0 0 0 0 0 0
  4667. 1.8678 0.5544 1.3552 H 0 0 0 0 0 0 0 0 0 0 0 0
  4668. 1 2 2 0
  4669. 2 3 1 0
  4670. 3 4 2 0
  4671. 4 5 1 0
  4672. 5 6 2 0
  4673. 6 1 1 0
  4674. 1 7 1 0
  4675. 2 8 1 0
  4676. 3 9 1 0
  4677. 5 10 1 0
  4678. 6 11 1 0
  4679. M END
  4680. $$$$
  4681. RDKit 3D
  4682. 11 11 0 0 0 0 0 0 0 0999 V2000
  4683. -0.2702 0.4431 1.0641 C 0 0 0 0 0 0 0 0 0 0 0 0
  4684. -1.2785 0.0842 0.1757 C 0 0 0 0 0 0 0 0 0 0 0 0
  4685. -0.9129 -0.4300 -1.0581 C 0 0 0 0 0 0 0 0 0 0 0 0
  4686. 0.3682 -0.6038 -1.4501 N 0 0 0 0 0 0 0 0 0 0 0 0
  4687. 1.3253 -0.2464 -0.5663 C 0 0 0 0 0 0 0 0 0 0 0 0
  4688. 1.0589 0.2760 0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0
  4689. -0.5180 0.8495 2.0403 H 0 0 0 0 0 0 0 0 0 0 0 0
  4690. -2.3238 0.2020 0.4375 H 0 0 0 0 0 0 0 0 0 0 0 0
  4691. -1.6631 -0.7247 -1.7861 H 0 0 0 0 0 0 0 0 0 0 0 0
  4692. 2.3464 -0.3958 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0
  4693. 1.8678 0.5459 1.3586 H 0 0 0 0 0 0 0 0 0 0 0 0
  4694. 1 2 2 0
  4695. 2 3 1 0
  4696. 3 4 2 0
  4697. 4 5 1 0
  4698. 5 6 2 0
  4699. 6 1 1 0
  4700. 1 7 1 0
  4701. 2 8 1 0
  4702. 3 9 1 0
  4703. 5 10 1 0
  4704. 6 11 1 0
  4705. M END
  4706. $$$$
  4707. RDKit 3D
  4708. 11 11 0 0 0 0 0 0 0 0999 V2000
  4709. -0.2702 0.4364 1.0668 C 0 0 0 0 0 0 0 0 0 0 0 0
  4710. -1.2785 0.0831 0.1762 C 0 0 0 0 0 0 0 0 0 0 0 0
  4711. -0.9129 -0.4233 -1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
  4712. 0.3682 -0.5946 -1.4538 N 0 0 0 0 0 0 0 0 0 0 0 0
  4713. 1.3253 -0.2428 -0.5678 C 0 0 0 0 0 0 0 0 0 0 0 0
  4714. 1.0589 0.2716 0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0
  4715. -0.5180 0.8367 2.0456 H 0 0 0 0 0 0 0 0 0 0 0 0
  4716. -2.3238 0.1993 0.4388 H 0 0 0 0 0 0 0 0 0 0 0 0
  4717. -1.6631 -0.7135 -1.7906 H 0 0 0 0 0 0 0 0 0 0 0 0
  4718. 2.3464 -0.3901 -0.9075 H 0 0 0 0 0 0 0 0 0 0 0 0
  4719. 1.8678 0.5373 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0
  4720. 1 2 2 0
  4721. 2 3 1 0
  4722. 3 4 2 0
  4723. 4 5 1 0
  4724. 5 6 2 0
  4725. 6 1 1 0
  4726. 1 7 1 0
  4727. 2 8 1 0
  4728. 3 9 1 0
  4729. 5 10 1 0
  4730. 6 11 1 0
  4731. M END
  4732. $$$$
  4733. RDKit 3D
  4734. 11 11 0 0 0 0 0 0 0 0999 V2000
  4735. -0.2702 0.4297 1.0696 C 0 0 0 0 0 0 0 0 0 0 0 0
  4736. -1.2785 0.0820 0.1768 C 0 0 0 0 0 0 0 0 0 0 0 0
  4737. -0.9129 -0.4167 -1.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
  4738. 0.3682 -0.5855 -1.4575 N 0 0 0 0 0 0 0 0 0 0 0 0
  4739. 1.3253 -0.2392 -0.5693 C 0 0 0 0 0 0 0 0 0 0 0 0
  4740. 1.0589 0.2673 0.6928 C 0 0 0 0 0 0 0 0 0 0 0 0
  4741. -0.5180 0.8238 2.0508 H 0 0 0 0 0 0 0 0 0 0 0 0
  4742. -2.3238 0.1965 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  4743. -1.6631 -0.7022 -1.7951 H 0 0 0 0 0 0 0 0 0 0 0 0
  4744. 2.3464 -0.3844 -0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0
  4745. 1.8678 0.5287 1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0
  4746. 1 2 2 0
  4747. 2 3 1 0
  4748. 3 4 2 0
  4749. 4 5 1 0
  4750. 5 6 2 0
  4751. 6 1 1 0
  4752. 1 7 1 0
  4753. 2 8 1 0
  4754. 3 9 1 0
  4755. 5 10 1 0
  4756. 6 11 1 0
  4757. M END
  4758. $$$$
  4759. RDKit 3D
  4760. 11 11 0 0 0 0 0 0 0 0999 V2000
  4761. -0.2702 0.4229 1.0722 C 0 0 0 0 0 0 0 0 0 0 0 0
  4762. -1.2785 0.0809 0.1773 C 0 0 0 0 0 0 0 0 0 0 0 0
  4763. -0.9129 -0.4100 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0
  4764. 0.3682 -0.5763 -1.4612 N 0 0 0 0 0 0 0 0 0 0 0 0
  4765. 1.3253 -0.2357 -0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0
  4766. 1.0589 0.2629 0.6944 C 0 0 0 0 0 0 0 0 0 0 0 0
  4767. -0.5180 0.8109 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  4768. -2.3238 0.1937 0.4412 H 0 0 0 0 0 0 0 0 0 0 0 0
  4769. -1.6631 -0.6909 -1.7995 H 0 0 0 0 0 0 0 0 0 0 0 0
  4770. 2.3464 -0.3787 -0.9123 H 0 0 0 0 0 0 0 0 0 0 0 0
  4771. 1.8678 0.5202 1.3687 H 0 0 0 0 0 0 0 0 0 0 0 0
  4772. 1 2 2 0
  4773. 2 3 1 0
  4774. 3 4 2 0
  4775. 4 5 1 0
  4776. 5 6 2 0
  4777. 6 1 1 0
  4778. 1 7 1 0
  4779. 2 8 1 0
  4780. 3 9 1 0
  4781. 5 10 1 0
  4782. 6 11 1 0
  4783. M END
  4784. $$$$
  4785. RDKit 3D
  4786. 11 11 0 0 0 0 0 0 0 0999 V2000
  4787. -0.2702 0.4162 1.0749 C 0 0 0 0 0 0 0 0 0 0 0 0
  4788. -1.2785 0.0798 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
  4789. -0.9129 -0.4033 -1.0686 C 0 0 0 0 0 0 0 0 0 0 0 0
  4790. 0.3682 -0.5671 -1.4648 N 0 0 0 0 0 0 0 0 0 0 0 0
  4791. 1.3253 -0.2321 -0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0
  4792. 1.0589 0.2586 0.6961 C 0 0 0 0 0 0 0 0 0 0 0 0
  4793. -0.5180 0.7980 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  4794. -2.3238 0.1909 0.4425 H 0 0 0 0 0 0 0 0 0 0 0 0
  4795. -1.6631 -0.6796 -1.8038 H 0 0 0 0 0 0 0 0 0 0 0 0
  4796. 2.3464 -0.3729 -0.9147 H 0 0 0 0 0 0 0 0 0 0 0 0
  4797. 1.8678 0.5115 1.3719 H 0 0 0 0 0 0 0 0 0 0 0 0
  4798. 1 2 2 0
  4799. 2 3 1 0
  4800. 3 4 2 0
  4801. 4 5 1 0
  4802. 5 6 2 0
  4803. 6 1 1 0
  4804. 1 7 1 0
  4805. 2 8 1 0
  4806. 3 9 1 0
  4807. 5 10 1 0
  4808. 6 11 1 0
  4809. M END
  4810. $$$$
  4811. RDKit 3D
  4812. 11 11 0 0 0 0 0 0 0 0999 V2000
  4813. -0.2702 0.4094 1.0775 C 0 0 0 0 0 0 0 0 0 0 0 0
  4814. -1.2785 0.0787 0.1783 C 0 0 0 0 0 0 0 0 0 0 0 0
  4815. -0.9129 -0.3965 -1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0
  4816. 0.3682 -0.5579 -1.4683 N 0 0 0 0 0 0 0 0 0 0 0 0
  4817. 1.3253 -0.2285 -0.5737 C 0 0 0 0 0 0 0 0 0 0 0 0
  4818. 1.0589 0.2542 0.6977 C 0 0 0 0 0 0 0 0 0 0 0 0
  4819. -0.5180 0.7850 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
  4820. -2.3238 0.1882 0.4436 H 0 0 0 0 0 0 0 0 0 0 0 0
  4821. -1.6631 -0.6683 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0
  4822. 2.3464 -0.3672 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
  4823. 1.8678 0.5029 1.3751 H 0 0 0 0 0 0 0 0 0 0 0 0
  4824. 1 2 2 0
  4825. 2 3 1 0
  4826. 3 4 2 0
  4827. 4 5 1 0
  4828. 5 6 2 0
  4829. 6 1 1 0
  4830. 1 7 1 0
  4831. 2 8 1 0
  4832. 3 9 1 0
  4833. 5 10 1 0
  4834. 6 11 1 0
  4835. M END
  4836. $$$$
  4837. RDKit 3D
  4838. 11 11 0 0 0 0 0 0 0 0999 V2000
  4839. -0.2702 0.4026 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  4840. -1.2785 0.0775 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0
  4841. -0.9129 -0.3898 -1.0736 C 0 0 0 0 0 0 0 0 0 0 0 0
  4842. 0.3682 -0.5487 -1.4718 N 0 0 0 0 0 0 0 0 0 0 0 0
  4843. 1.3253 -0.2249 -0.5752 C 0 0 0 0 0 0 0 0 0 0 0 0
  4844. 1.0589 0.2498 0.6993 C 0 0 0 0 0 0 0 0 0 0 0 0
  4845. -0.5180 0.7720 2.0709 H 0 0 0 0 0 0 0 0 0 0 0 0
  4846. -2.3238 0.1854 0.4448 H 0 0 0 0 0 0 0 0 0 0 0 0
  4847. -1.6631 -0.6569 -1.8122 H 0 0 0 0 0 0 0 0 0 0 0 0
  4848. 2.3464 -0.3614 -0.9193 H 0 0 0 0 0 0 0 0 0 0 0 0
  4849. 1.8678 0.4943 1.3782 H 0 0 0 0 0 0 0 0 0 0 0 0
  4850. 1 2 2 0
  4851. 2 3 1 0
  4852. 3 4 2 0
  4853. 4 5 1 0
  4854. 5 6 2 0
  4855. 6 1 1 0
  4856. 1 7 1 0
  4857. 2 8 1 0
  4858. 3 9 1 0
  4859. 5 10 1 0
  4860. 6 11 1 0
  4861. M END
  4862. $$$$
  4863. RDKit 3D
  4864. 11 11 0 0 0 0 0 0 0 0999 V2000
  4865. -0.2702 0.3958 1.0825 C 0 0 0 0 0 0 0 0 0 0 0 0
  4866. -1.2785 0.0764 0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0
  4867. -0.9129 -0.3830 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0
  4868. 0.3682 -0.5394 -1.4752 N 0 0 0 0 0 0 0 0 0 0 0 0
  4869. 1.3253 -0.2212 -0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0
  4870. 1.0589 0.2454 0.7008 C 0 0 0 0 0 0 0 0 0 0 0 0
  4871. -0.5180 0.7590 2.0757 H 0 0 0 0 0 0 0 0 0 0 0 0
  4872. -2.3238 0.1826 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  4873. -1.6631 -0.6455 -1.8162 H 0 0 0 0 0 0 0 0 0 0 0 0
  4874. 2.3464 -0.3556 -0.9215 H 0 0 0 0 0 0 0 0 0 0 0 0
  4875. 1.8678 0.4856 1.3813 H 0 0 0 0 0 0 0 0 0 0 0 0
  4876. 1 2 2 0
  4877. 2 3 1 0
  4878. 3 4 2 0
  4879. 4 5 1 0
  4880. 5 6 2 0
  4881. 6 1 1 0
  4882. 1 7 1 0
  4883. 2 8 1 0
  4884. 3 9 1 0
  4885. 5 10 1 0
  4886. 6 11 1 0
  4887. M END
  4888. $$$$
  4889. RDKit 3D
  4890. 11 11 0 0 0 0 0 0 0 0999 V2000
  4891. -0.2702 0.3890 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  4892. -1.2785 0.0753 0.1797 C 0 0 0 0 0 0 0 0 0 0 0 0
  4893. -0.9129 -0.3763 -1.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
  4894. 0.3682 -0.5301 -1.4786 N 0 0 0 0 0 0 0 0 0 0 0 0
  4895. 1.3253 -0.2176 -0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0
  4896. 1.0589 0.2410 0.7023 C 0 0 0 0 0 0 0 0 0 0 0 0
  4897. -0.5180 0.7460 2.0804 H 0 0 0 0 0 0 0 0 0 0 0 0
  4898. -2.3238 0.1798 0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0
  4899. -1.6631 -0.6341 -1.8203 H 0 0 0 0 0 0 0 0 0 0 0 0
  4900. 2.3464 -0.3498 -0.9238 H 0 0 0 0 0 0 0 0 0 0 0 0
  4901. 1.8678 0.4769 1.3843 H 0 0 0 0 0 0 0 0 0 0 0 0
  4902. 1 2 2 0
  4903. 2 3 1 0
  4904. 3 4 2 0
  4905. 4 5 1 0
  4906. 5 6 2 0
  4907. 6 1 1 0
  4908. 1 7 1 0
  4909. 2 8 1 0
  4910. 3 9 1 0
  4911. 5 10 1 0
  4912. 6 11 1 0
  4913. M END
  4914. $$$$
  4915. RDKit 3D
  4916. 11 11 0 0 0 0 0 0 0 0999 V2000
  4917. -0.2702 0.3822 1.0874 C 0 0 0 0 0 0 0 0 0 0 0 0
  4918. -1.2785 0.0742 0.1802 C 0 0 0 0 0 0 0 0 0 0 0 0
  4919. -0.9129 -0.3695 -1.0807 C 0 0 0 0 0 0 0 0 0 0 0 0
  4920. 0.3682 -0.5208 -1.4819 N 0 0 0 0 0 0 0 0 0 0 0 0
  4921. 1.3253 -0.2140 -0.5793 C 0 0 0 0 0 0 0 0 0 0 0 0
  4922. 1.0589 0.2366 0.7039 C 0 0 0 0 0 0 0 0 0 0 0 0
  4923. -0.5180 0.7329 2.0851 H 0 0 0 0 0 0 0 0 0 0 0 0
  4924. -2.3238 0.1770 0.4482 H 0 0 0 0 0 0 0 0 0 0 0 0
  4925. -1.6631 -0.6226 -1.8242 H 0 0 0 0 0 0 0 0 0 0 0 0
  4926. 2.3464 -0.3440 -0.9259 H 0 0 0 0 0 0 0 0 0 0 0 0
  4927. 1.8678 0.4682 1.3873 H 0 0 0 0 0 0 0 0 0 0 0 0
  4928. 1 2 2 0
  4929. 2 3 1 0
  4930. 3 4 2 0
  4931. 4 5 1 0
  4932. 5 6 2 0
  4933. 6 1 1 0
  4934. 1 7 1 0
  4935. 2 8 1 0
  4936. 3 9 1 0
  4937. 5 10 1 0
  4938. 6 11 1 0
  4939. M END
  4940. $$$$
  4941. RDKit 3D
  4942. 11 11 0 0 0 0 0 0 0 0999 V2000
  4943. -0.2702 0.3754 1.0898 C 0 0 0 0 0 0 0 0 0 0 0 0
  4944. -1.2785 0.0730 0.1807 C 0 0 0 0 0 0 0 0 0 0 0 0
  4945. -0.9129 -0.3627 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
  4946. 0.3682 -0.5115 -1.4851 N 0 0 0 0 0 0 0 0 0 0 0 0
  4947. 1.3253 -0.2103 -0.5806 C 0 0 0 0 0 0 0 0 0 0 0 0
  4948. 1.0589 0.2321 0.7053 C 0 0 0 0 0 0 0 0 0 0 0 0
  4949. -0.5180 0.7198 2.0896 H 0 0 0 0 0 0 0 0 0 0 0 0
  4950. -2.3238 0.1741 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0
  4951. -1.6631 -0.6111 -1.8281 H 0 0 0 0 0 0 0 0 0 0 0 0
  4952. 2.3464 -0.3382 -0.9281 H 0 0 0 0 0 0 0 0 0 0 0 0
  4953. 1.8678 0.4595 1.3902 H 0 0 0 0 0 0 0 0 0 0 0 0
  4954. 1 2 2 0
  4955. 2 3 1 0
  4956. 3 4 2 0
  4957. 4 5 1 0
  4958. 5 6 2 0
  4959. 6 1 1 0
  4960. 1 7 1 0
  4961. 2 8 1 0
  4962. 3 9 1 0
  4963. 5 10 1 0
  4964. 6 11 1 0
  4965. M END
  4966. $$$$
  4967. RDKit 3D
  4968. 11 11 0 0 0 0 0 0 0 0999 V2000
  4969. -0.2702 0.3685 1.0921 C 0 0 0 0 0 0 0 0 0 0 0 0
  4970. -1.2785 0.0719 0.1811 C 0 0 0 0 0 0 0 0 0 0 0 0
  4971. -0.9129 -0.3559 -1.0853 C 0 0 0 0 0 0 0 0 0 0 0 0
  4972. 0.3682 -0.5022 -1.4883 N 0 0 0 0 0 0 0 0 0 0 0 0
  4973. 1.3253 -0.2067 -0.5819 C 0 0 0 0 0 0 0 0 0 0 0 0
  4974. 1.0589 0.2277 0.7068 C 0 0 0 0 0 0 0 0 0 0 0 0
  4975. -0.5180 0.7066 2.0941 H 0 0 0 0 0 0 0 0 0 0 0 0
  4976. -2.3238 0.1713 0.4504 H 0 0 0 0 0 0 0 0 0 0 0 0
  4977. -1.6631 -0.5996 -1.8319 H 0 0 0 0 0 0 0 0 0 0 0 0
  4978. 2.3464 -0.3324 -0.9302 H 0 0 0 0 0 0 0 0 0 0 0 0
  4979. 1.8678 0.4507 1.3931 H 0 0 0 0 0 0 0 0 0 0 0 0
  4980. 1 2 2 0
  4981. 2 3 1 0
  4982. 3 4 2 0
  4983. 4 5 1 0
  4984. 5 6 2 0
  4985. 6 1 1 0
  4986. 1 7 1 0
  4987. 2 8 1 0
  4988. 3 9 1 0
  4989. 5 10 1 0
  4990. 6 11 1 0
  4991. M END
  4992. $$$$
  4993. RDKit 3D
  4994. 11 11 0 0 0 0 0 0 0 0999 V2000
  4995. -0.2702 0.3616 1.0944 C 0 0 0 0 0 0 0 0 0 0 0 0
  4996. -1.2785 0.0707 0.1816 C 0 0 0 0 0 0 0 0 0 0 0 0
  4997. -0.9129 -0.3491 -1.0875 C 0 0 0 0 0 0 0 0 0 0 0 0
  4998. 0.3682 -0.4928 -1.4914 N 0 0 0 0 0 0 0 0 0 0 0 0
  4999. 1.3253 -0.2030 -0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0
  5000. 1.0589 0.2233 0.7082 C 0 0 0 0 0 0 0 0 0 0 0 0
  5001. -0.5180 0.6934 2.0985 H 0 0 0 0 0 0 0 0 0 0 0 0
  5002. -2.3238 0.1685 0.4515 H 0 0 0 0 0 0 0 0 0 0 0 0
  5003. -1.6631 -0.5881 -1.8356 H 0 0 0 0 0 0 0 0 0 0 0 0
  5004. 2.3464 -0.3265 -0.9323 H 0 0 0 0 0 0 0 0 0 0 0 0
  5005. 1.8678 0.4420 1.3959 H 0 0 0 0 0 0 0 0 0 0 0 0
  5006. 1 2 2 0
  5007. 2 3 1 0
  5008. 3 4 2 0
  5009. 4 5 1 0
  5010. 5 6 2 0
  5011. 6 1 1 0
  5012. 1 7 1 0
  5013. 2 8 1 0
  5014. 3 9 1 0
  5015. 5 10 1 0
  5016. 6 11 1 0
  5017. M END
  5018. $$$$
  5019. RDKit 3D
  5020. 11 11 0 0 0 0 0 0 0 0999 V2000
  5021. -0.2702 0.3548 1.0967 C 0 0 0 0 0 0 0 0 0 0 0 0
  5022. -1.2785 0.0696 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0
  5023. -0.9129 -0.3422 -1.0897 C 0 0 0 0 0 0 0 0 0 0 0 0
  5024. 0.3682 -0.4834 -1.4945 N 0 0 0 0 0 0 0 0 0 0 0 0
  5025. 1.3253 -0.1994 -0.5845 C 0 0 0 0 0 0 0 0 0 0 0 0
  5026. 1.0589 0.2188 0.7096 C 0 0 0 0 0 0 0 0 0 0 0 0
  5027. -0.5180 0.6802 2.1028 H 0 0 0 0 0 0 0 0 0 0 0 0
  5028. -2.3238 0.1656 0.4525 H 0 0 0 0 0 0 0 0 0 0 0 0
  5029. -1.6631 -0.5766 -1.8393 H 0 0 0 0 0 0 0 0 0 0 0 0
  5030. 2.3464 -0.3206 -0.9343 H 0 0 0 0 0 0 0 0 0 0 0 0
  5031. 1.8678 0.4332 1.3986 H 0 0 0 0 0 0 0 0 0 0 0 0
  5032. 1 2 2 0
  5033. 2 3 1 0
  5034. 3 4 2 0
  5035. 4 5 1 0
  5036. 5 6 2 0
  5037. 6 1 1 0
  5038. 1 7 1 0
  5039. 2 8 1 0
  5040. 3 9 1 0
  5041. 5 10 1 0
  5042. 6 11 1 0
  5043. M END
  5044. $$$$
  5045. RDKit 3D
  5046. 11 11 0 0 0 0 0 0 0 0999 V2000
  5047. -0.2702 0.3479 1.0989 C 0 0 0 0 0 0 0 0 0 0 0 0
  5048. -1.2785 0.0685 0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0
  5049. -0.9129 -0.3354 -1.0918 C 0 0 0 0 0 0 0 0 0 0 0 0
  5050. 0.3682 -0.4740 -1.4975 N 0 0 0 0 0 0 0 0 0 0 0 0
  5051. 1.3253 -0.1957 -0.5857 C 0 0 0 0 0 0 0 0 0 0 0 0
  5052. 1.0589 0.2143 0.7109 C 0 0 0 0 0 0 0 0 0 0 0 0
  5053. -0.5180 0.6670 2.1071 H 0 0 0 0 0 0 0 0 0 0 0 0
  5054. -2.3238 0.1628 0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0
  5055. -1.6631 -0.5650 -1.8429 H 0 0 0 0 0 0 0 0 0 0 0 0
  5056. 2.3464 -0.3148 -0.9363 H 0 0 0 0 0 0 0 0 0 0 0 0
  5057. 1.8678 0.4244 1.4013 H 0 0 0 0 0 0 0 0 0 0 0 0
  5058. 1 2 2 0
  5059. 2 3 1 0
  5060. 3 4 2 0
  5061. 4 5 1 0
  5062. 5 6 2 0
  5063. 6 1 1 0
  5064. 1 7 1 0
  5065. 2 8 1 0
  5066. 3 9 1 0
  5067. 5 10 1 0
  5068. 6 11 1 0
  5069. M END
  5070. $$$$
  5071. RDKit 3D
  5072. 11 11 0 0 0 0 0 0 0 0999 V2000
  5073. -0.2702 0.3410 1.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
  5074. -1.2785 0.0673 0.1829 C 0 0 0 0 0 0 0 0 0 0 0 0
  5075. -0.9129 -0.3285 -1.0939 C 0 0 0 0 0 0 0 0 0 0 0 0
  5076. 0.3682 -0.4646 -1.5004 N 0 0 0 0 0 0 0 0 0 0 0 0
  5077. 1.3253 -0.1920 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0
  5078. 1.0589 0.2099 0.7123 C 0 0 0 0 0 0 0 0 0 0 0 0
  5079. -0.5180 0.6538 2.1112 H 0 0 0 0 0 0 0 0 0 0 0 0
  5080. -2.3238 0.1599 0.4546 H 0 0 0 0 0 0 0 0 0 0 0 0
  5081. -1.6631 -0.5534 -1.8464 H 0 0 0 0 0 0 0 0 0 0 0 0
  5082. 2.3464 -0.3089 -0.9383 H 0 0 0 0 0 0 0 0 0 0 0 0
  5083. 1.8678 0.4156 1.4039 H 0 0 0 0 0 0 0 0 0 0 0 0
  5084. 1 2 2 0
  5085. 2 3 1 0
  5086. 3 4 2 0
  5087. 4 5 1 0
  5088. 5 6 2 0
  5089. 6 1 1 0
  5090. 1 7 1 0
  5091. 2 8 1 0
  5092. 3 9 1 0
  5093. 5 10 1 0
  5094. 6 11 1 0
  5095. M END
  5096. $$$$
  5097. RDKit 3D
  5098. 11 11 0 0 0 0 0 0 0 0999 V2000
  5099. -0.2702 0.3340 1.1032 C 0 0 0 0 0 0 0 0 0 0 0 0
  5100. -1.2785 0.0662 0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0
  5101. -0.9129 -0.3216 -1.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
  5102. 0.3682 -0.4552 -1.5033 N 0 0 0 0 0 0 0 0 0 0 0 0
  5103. 1.3253 -0.1883 -0.5882 C 0 0 0 0 0 0 0 0 0 0 0 0
  5104. 1.0589 0.2054 0.7136 C 0 0 0 0 0 0 0 0 0 0 0 0
  5105. -0.5180 0.6405 2.1153 H 0 0 0 0 0 0 0 0 0 0 0 0
  5106. -2.3238 0.1571 0.4556 H 0 0 0 0 0 0 0 0 0 0 0 0
  5107. -1.6631 -0.5418 -1.8498 H 0 0 0 0 0 0 0 0 0 0 0 0
  5108. 2.3464 -0.3030 -0.9402 H 0 0 0 0 0 0 0 0 0 0 0 0
  5109. 1.8678 0.4068 1.4065 H 0 0 0 0 0 0 0 0 0 0 0 0
  5110. 1 2 2 0
  5111. 2 3 1 0
  5112. 3 4 2 0
  5113. 4 5 1 0
  5114. 5 6 2 0
  5115. 6 1 1 0
  5116. 1 7 1 0
  5117. 2 8 1 0
  5118. 3 9 1 0
  5119. 5 10 1 0
  5120. 6 11 1 0
  5121. M END
  5122. $$$$
  5123. RDKit 3D
  5124. 11 11 0 0 0 0 0 0 0 0999 V2000
  5125. -0.2702 0.3271 1.1053 C 0 0 0 0 0 0 0 0 0 0 0 0
  5126. -1.2785 0.0650 0.1837 C 0 0 0 0 0 0 0 0 0 0 0 0
  5127. -0.9129 -0.3147 -1.0979 C 0 0 0 0 0 0 0 0 0 0 0 0
  5128. 0.3682 -0.4457 -1.5062 N 0 0 0 0 0 0 0 0 0 0 0 0
  5129. 1.3253 -0.1846 -0.5893 C 0 0 0 0 0 0 0 0 0 0 0 0
  5130. 1.0589 0.2009 0.7148 C 0 0 0 0 0 0 0 0 0 0 0 0
  5131. -0.5180 0.6272 2.1192 H 0 0 0 0 0 0 0 0 0 0 0 0
  5132. -2.3238 0.1542 0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
  5133. -1.6631 -0.5302 -1.8532 H 0 0 0 0 0 0 0 0 0 0 0 0
  5134. 2.3464 -0.2971 -0.9421 H 0 0 0 0 0 0 0 0 0 0 0 0
  5135. 1.8678 0.3979 1.4091 H 0 0 0 0 0 0 0 0 0 0 0 0
  5136. 1 2 2 0
  5137. 2 3 1 0
  5138. 3 4 2 0
  5139. 4 5 1 0
  5140. 5 6 2 0
  5141. 6 1 1 0
  5142. 1 7 1 0
  5143. 2 8 1 0
  5144. 3 9 1 0
  5145. 5 10 1 0
  5146. 6 11 1 0
  5147. M END
  5148. $$$$
  5149. RDKit 3D
  5150. 11 11 0 0 0 0 0 0 0 0999 V2000
  5151. -0.2702 0.3201 1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0
  5152. -1.2785 0.0639 0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0
  5153. -0.9129 -0.3078 -1.0999 C 0 0 0 0 0 0 0 0 0 0 0 0
  5154. 0.3682 -0.4363 -1.5089 N 0 0 0 0 0 0 0 0 0 0 0 0
  5155. 1.3253 -0.1809 -0.5905 C 0 0 0 0 0 0 0 0 0 0 0 0
  5156. 1.0589 0.1964 0.7161 C 0 0 0 0 0 0 0 0 0 0 0 0
  5157. -0.5180 0.6138 2.1231 H 0 0 0 0 0 0 0 0 0 0 0 0
  5158. -2.3238 0.1513 0.4575 H 0 0 0 0 0 0 0 0 0 0 0 0
  5159. -1.6631 -0.5185 -1.8565 H 0 0 0 0 0 0 0 0 0 0 0 0
  5160. 2.3464 -0.2911 -0.9439 H 0 0 0 0 0 0 0 0 0 0 0 0
  5161. 1.8678 0.3890 1.4115 H 0 0 0 0 0 0 0 0 0 0 0 0
  5162. 1 2 2 0
  5163. 2 3 1 0
  5164. 3 4 2 0
  5165. 4 5 1 0
  5166. 5 6 2 0
  5167. 6 1 1 0
  5168. 1 7 1 0
  5169. 2 8 1 0
  5170. 3 9 1 0
  5171. 5 10 1 0
  5172. 6 11 1 0
  5173. M END
  5174. $$$$
  5175. RDKit 3D
  5176. 11 11 0 0 0 0 0 0 0 0999 V2000
  5177. -0.2702 0.3132 1.1093 C 0 0 0 0 0 0 0 0 0 0 0 0
  5178. -1.2785 0.0627 0.1845 C 0 0 0 0 0 0 0 0 0 0 0 0
  5179. -0.9129 -0.3009 -1.1018 C 0 0 0 0 0 0 0 0 0 0 0 0
  5180. 0.3682 -0.4268 -1.5116 N 0 0 0 0 0 0 0 0 0 0 0 0
  5181. 1.3253 -0.1772 -0.5916 C 0 0 0 0 0 0 0 0 0 0 0 0
  5182. 1.0589 0.1919 0.7173 C 0 0 0 0 0 0 0 0 0 0 0 0
  5183. -0.5180 0.6005 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0
  5184. -2.3238 0.1485 0.4585 H 0 0 0 0 0 0 0 0 0 0 0 0
  5185. -1.6631 -0.5068 -1.8597 H 0 0 0 0 0 0 0 0 0 0 0 0
  5186. 2.3464 -0.2852 -0.9457 H 0 0 0 0 0 0 0 0 0 0 0 0
  5187. 1.8678 0.3802 1.4139 H 0 0 0 0 0 0 0 0 0 0 0 0
  5188. 1 2 2 0
  5189. 2 3 1 0
  5190. 3 4 2 0
  5191. 4 5 1 0
  5192. 5 6 2 0
  5193. 6 1 1 0
  5194. 1 7 1 0
  5195. 2 8 1 0
  5196. 3 9 1 0
  5197. 5 10 1 0
  5198. 6 11 1 0
  5199. M END
  5200. $$$$
  5201. RDKit 3D
  5202. 11 11 0 0 0 0 0 0 0 0999 V2000
  5203. -0.2702 0.3062 1.1112 C 0 0 0 0 0 0 0 0 0 0 0 0
  5204. -1.2785 0.0615 0.1849 C 0 0 0 0 0 0 0 0 0 0 0 0
  5205. -0.9129 -0.2940 -1.1037 C 0 0 0 0 0 0 0 0 0 0 0 0
  5206. 0.3682 -0.4173 -1.5143 N 0 0 0 0 0 0 0 0 0 0 0 0
  5207. 1.3253 -0.1735 -0.5927 C 0 0 0 0 0 0 0 0 0 0 0 0
  5208. 1.0589 0.1874 0.7185 C 0 0 0 0 0 0 0 0 0 0 0 0
  5209. -0.5180 0.5871 2.1307 H 0 0 0 0 0 0 0 0 0 0 0 0
  5210. -2.3238 0.1456 0.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
  5211. -1.6631 -0.4951 -1.8629 H 0 0 0 0 0 0 0 0 0 0 0 0
  5212. 2.3464 -0.2793 -0.9475 H 0 0 0 0 0 0 0 0 0 0 0 0
  5213. 1.8678 0.3713 1.4163 H 0 0 0 0 0 0 0 0 0 0 0 0
  5214. 1 2 2 0
  5215. 2 3 1 0
  5216. 3 4 2 0
  5217. 4 5 1 0
  5218. 5 6 2 0
  5219. 6 1 1 0
  5220. 1 7 1 0
  5221. 2 8 1 0
  5222. 3 9 1 0
  5223. 5 10 1 0
  5224. 6 11 1 0
  5225. M END
  5226. $$$$
  5227. RDKit 3D
  5228. 11 11 0 0 0 0 0 0 0 0999 V2000
  5229. -0.2702 0.2992 1.1131 C 0 0 0 0 0 0 0 0 0 0 0 0
  5230. -1.2785 0.0604 0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0
  5231. -0.9129 -0.2870 -1.1055 C 0 0 0 0 0 0 0 0 0 0 0 0
  5232. 0.3682 -0.4077 -1.5169 N 0 0 0 0 0 0 0 0 0 0 0 0
  5233. 1.3253 -0.1697 -0.5938 C 0 0 0 0 0 0 0 0 0 0 0 0
  5234. 1.0589 0.1829 0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0
  5235. -0.5180 0.5737 2.1343 H 0 0 0 0 0 0 0 0 0 0 0 0
  5236. -2.3238 0.1427 0.4603 H 0 0 0 0 0 0 0 0 0 0 0 0
  5237. -1.6631 -0.4834 -1.8659 H 0 0 0 0 0 0 0 0 0 0 0 0
  5238. 2.3464 -0.2733 -0.9492 H 0 0 0 0 0 0 0 0 0 0 0 0
  5239. 1.8678 0.3624 1.4186 H 0 0 0 0 0 0 0 0 0 0 0 0
  5240. 1 2 2 0
  5241. 2 3 1 0
  5242. 3 4 2 0
  5243. 4 5 1 0
  5244. 5 6 2 0
  5245. 6 1 1 0
  5246. 1 7 1 0
  5247. 2 8 1 0
  5248. 3 9 1 0
  5249. 5 10 1 0
  5250. 6 11 1 0
  5251. M END
  5252. $$$$
  5253. RDKit 3D
  5254. 11 11 0 0 0 0 0 0 0 0999 V2000
  5255. -0.2702 0.2922 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0
  5256. -1.2785 0.0592 0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0
  5257. -0.9129 -0.2801 -1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0
  5258. 0.3682 -0.3982 -1.5194 N 0 0 0 0 0 0 0 0 0 0 0 0
  5259. 1.3253 -0.1660 -0.5948 C 0 0 0 0 0 0 0 0 0 0 0 0
  5260. 1.0589 0.1784 0.7208 C 0 0 0 0 0 0 0 0 0 0 0 0
  5261. -0.5180 0.5603 2.1379 H 0 0 0 0 0 0 0 0 0 0 0 0
  5262. -2.3238 0.1398 0.4612 H 0 0 0 0 0 0 0 0 0 0 0 0
  5263. -1.6631 -0.4717 -1.8689 H 0 0 0 0 0 0 0 0 0 0 0 0
  5264. 2.3464 -0.2673 -0.9509 H 0 0 0 0 0 0 0 0 0 0 0 0
  5265. 1.8678 0.3535 1.4209 H 0 0 0 0 0 0 0 0 0 0 0 0
  5266. 1 2 2 0
  5267. 2 3 1 0
  5268. 3 4 2 0
  5269. 4 5 1 0
  5270. 5 6 2 0
  5271. 6 1 1 0
  5272. 1 7 1 0
  5273. 2 8 1 0
  5274. 3 9 1 0
  5275. 5 10 1 0
  5276. 6 11 1 0
  5277. M END
  5278. $$$$
  5279. RDKit 3D
  5280. 11 11 0 0 0 0 0 0 0 0999 V2000
  5281. -0.2702 0.2852 1.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
  5282. -1.2785 0.0580 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  5283. -0.9129 -0.2731 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0
  5284. 0.3682 -0.3887 -1.5219 N 0 0 0 0 0 0 0 0 0 0 0 0
  5285. 1.3253 -0.1623 -0.5959 C 0 0 0 0 0 0 0 0 0 0 0 0
  5286. 1.0589 0.1738 0.7219 C 0 0 0 0 0 0 0 0 0 0 0 0
  5287. -0.5180 0.5469 2.1414 H 0 0 0 0 0 0 0 0 0 0 0 0
  5288. -2.3238 0.1369 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0
  5289. -1.6631 -0.4599 -1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0
  5290. 2.3464 -0.2613 -0.9526 H 0 0 0 0 0 0 0 0 0 0 0 0
  5291. 1.8678 0.3445 1.4231 H 0 0 0 0 0 0 0 0 0 0 0 0
  5292. 1 2 2 0
  5293. 2 3 1 0
  5294. 3 4 2 0
  5295. 4 5 1 0
  5296. 5 6 2 0
  5297. 6 1 1 0
  5298. 1 7 1 0
  5299. 2 8 1 0
  5300. 3 9 1 0
  5301. 5 10 1 0
  5302. 6 11 1 0
  5303. M END
  5304. $$$$
  5305. RDKit 3D
  5306. 11 11 0 0 0 0 0 0 0 0999 V2000
  5307. -0.2702 0.2782 1.1186 C 0 0 0 0 0 0 0 0 0 0 0 0
  5308. -1.2785 0.0569 0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0
  5309. -0.9129 -0.2662 -1.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
  5310. 0.3682 -0.3791 -1.5243 N 0 0 0 0 0 0 0 0 0 0 0 0
  5311. 1.3253 -0.1585 -0.5969 C 0 0 0 0 0 0 0 0 0 0 0 0
  5312. 1.0589 0.1693 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0
  5313. -0.5180 0.5334 2.1448 H 0 0 0 0 0 0 0 0 0 0 0 0
  5314. -2.3238 0.1340 0.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
  5315. -1.6631 -0.4482 -1.8747 H 0 0 0 0 0 0 0 0 0 0 0 0
  5316. 2.3464 -0.2554 -0.9542 H 0 0 0 0 0 0 0 0 0 0 0 0
  5317. 1.8678 0.3356 1.4252 H 0 0 0 0 0 0 0 0 0 0 0 0
  5318. 1 2 2 0
  5319. 2 3 1 0
  5320. 3 4 2 0
  5321. 4 5 1 0
  5322. 5 6 2 0
  5323. 6 1 1 0
  5324. 1 7 1 0
  5325. 2 8 1 0
  5326. 3 9 1 0
  5327. 5 10 1 0
  5328. 6 11 1 0
  5329. M END
  5330. $$$$
  5331. RDKit 3D
  5332. 11 11 0 0 0 0 0 0 0 0999 V2000
  5333. -0.2702 0.2711 1.1203 C 0 0 0 0 0 0 0 0 0 0 0 0
  5334. -1.2785 0.0557 0.1867 C 0 0 0 0 0 0 0 0 0 0 0 0
  5335. -0.9129 -0.2592 -1.1124 C 0 0 0 0 0 0 0 0 0 0 0 0
  5336. 0.3682 -0.3695 -1.5266 N 0 0 0 0 0 0 0 0 0 0 0 0
  5337. 1.3253 -0.1548 -0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0
  5338. 1.0589 0.1647 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0
  5339. -0.5180 0.5199 2.1481 H 0 0 0 0 0 0 0 0 0 0 0 0
  5340. -2.3238 0.1311 0.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  5341. -1.6631 -0.4364 -1.8775 H 0 0 0 0 0 0 0 0 0 0 0 0
  5342. 2.3464 -0.2494 -0.9558 H 0 0 0 0 0 0 0 0 0 0 0 0
  5343. 1.8678 0.3266 1.4273 H 0 0 0 0 0 0 0 0 0 0 0 0
  5344. 1 2 2 0
  5345. 2 3 1 0
  5346. 3 4 2 0
  5347. 4 5 1 0
  5348. 5 6 2 0
  5349. 6 1 1 0
  5350. 1 7 1 0
  5351. 2 8 1 0
  5352. 3 9 1 0
  5353. 5 10 1 0
  5354. 6 11 1 0
  5355. M END
  5356. $$$$
  5357. RDKit 3D
  5358. 11 11 0 0 0 0 0 0 0 0999 V2000
  5359. -0.2702 0.2641 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0
  5360. -1.2785 0.0545 0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0
  5361. -0.9129 -0.2522 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0
  5362. 0.3682 -0.3599 -1.5289 N 0 0 0 0 0 0 0 0 0 0 0 0
  5363. 1.3253 -0.1510 -0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0
  5364. 1.0589 0.1602 0.7251 C 0 0 0 0 0 0 0 0 0 0 0 0
  5365. -0.5180 0.5064 2.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
  5366. -2.3238 0.1282 0.4645 H 0 0 0 0 0 0 0 0 0 0 0 0
  5367. -1.6631 -0.4246 -1.8802 H 0 0 0 0 0 0 0 0 0 0 0 0
  5368. 2.3464 -0.2433 -0.9573 H 0 0 0 0 0 0 0 0 0 0 0 0
  5369. 1.8678 0.3176 1.4293 H 0 0 0 0 0 0 0 0 0 0 0 0
  5370. 1 2 2 0
  5371. 2 3 1 0
  5372. 3 4 2 0
  5373. 4 5 1 0
  5374. 5 6 2 0
  5375. 6 1 1 0
  5376. 1 7 1 0
  5377. 2 8 1 0
  5378. 3 9 1 0
  5379. 5 10 1 0
  5380. 6 11 1 0
  5381. M END
  5382. $$$$
  5383. RDKit 3D
  5384. 11 11 0 0 0 0 0 0 0 0999 V2000
  5385. -0.2702 0.2570 1.1236 C 0 0 0 0 0 0 0 0 0 0 0 0
  5386. -1.2785 0.0533 0.1874 C 0 0 0 0 0 0 0 0 0 0 0 0
  5387. -0.9129 -0.2452 -1.1155 C 0 0 0 0 0 0 0 0 0 0 0 0
  5388. 0.3682 -0.3503 -1.5312 N 0 0 0 0 0 0 0 0 0 0 0 0
  5389. 1.3253 -0.1472 -0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0
  5390. 1.0589 0.1556 0.7261 C 0 0 0 0 0 0 0 0 0 0 0 0
  5391. -0.5180 0.4929 2.1544 H 0 0 0 0 0 0 0 0 0 0 0 0
  5392. -2.3238 0.1252 0.4653 H 0 0 0 0 0 0 0 0 0 0 0 0
  5393. -1.6631 -0.4128 -1.8828 H 0 0 0 0 0 0 0 0 0 0 0 0
  5394. 2.3464 -0.2373 -0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0
  5395. 1.8678 0.3086 1.4313 H 0 0 0 0 0 0 0 0 0 0 0 0
  5396. 1 2 2 0
  5397. 2 3 1 0
  5398. 3 4 2 0
  5399. 4 5 1 0
  5400. 5 6 2 0
  5401. 6 1 1 0
  5402. 1 7 1 0
  5403. 2 8 1 0
  5404. 3 9 1 0
  5405. 5 10 1 0
  5406. 6 11 1 0
  5407. M END
  5408. $$$$
  5409. RDKit 3D
  5410. 11 11 0 0 0 0 0 0 0 0999 V2000
  5411. -0.2702 0.2500 1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
  5412. -1.2785 0.0522 0.1877 C 0 0 0 0 0 0 0 0 0 0 0 0
  5413. -0.9129 -0.2382 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0
  5414. 0.3682 -0.3407 -1.5333 N 0 0 0 0 0 0 0 0 0 0 0 0
  5415. 1.3253 -0.1435 -0.6007 C 0 0 0 0 0 0 0 0 0 0 0 0
  5416. 1.0589 0.1511 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0
  5417. -0.5180 0.4793 2.1575 H 0 0 0 0 0 0 0 0 0 0 0 0
  5418. -2.3238 0.1223 0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0
  5419. -1.6631 -0.4009 -1.8854 H 0 0 0 0 0 0 0 0 0 0 0 0
  5420. 2.3464 -0.2313 -0.9603 H 0 0 0 0 0 0 0 0 0 0 0 0
  5421. 1.8678 0.2997 1.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
  5422. 1 2 2 0
  5423. 2 3 1 0
  5424. 3 4 2 0
  5425. 4 5 1 0
  5426. 5 6 2 0
  5427. 6 1 1 0
  5428. 1 7 1 0
  5429. 2 8 1 0
  5430. 3 9 1 0
  5431. 5 10 1 0
  5432. 6 11 1 0
  5433. M END
  5434. $$$$
  5435. RDKit 3D
  5436. 11 11 0 0 0 0 0 0 0 0999 V2000
  5437. -0.2702 0.2429 1.1268 C 0 0 0 0 0 0 0 0 0 0 0 0
  5438. -1.2785 0.0510 0.1881 C 0 0 0 0 0 0 0 0 0 0 0 0
  5439. -0.9129 -0.2311 -1.1185 C 0 0 0 0 0 0 0 0 0 0 0 0
  5440. 0.3682 -0.3310 -1.5355 N 0 0 0 0 0 0 0 0 0 0 0 0
  5441. 1.3253 -0.1397 -0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0
  5442. 1.0589 0.1465 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0
  5443. -0.5180 0.4658 2.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
  5444. -2.3238 0.1194 0.4669 H 0 0 0 0 0 0 0 0 0 0 0 0
  5445. -1.6631 -0.3891 -1.8879 H 0 0 0 0 0 0 0 0 0 0 0 0
  5446. 2.3464 -0.2253 -0.9618 H 0 0 0 0 0 0 0 0 0 0 0 0
  5447. 1.8678 0.2906 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  5448. 1 2 2 0
  5449. 2 3 1 0
  5450. 3 4 2 0
  5451. 4 5 1 0
  5452. 5 6 2 0
  5453. 6 1 1 0
  5454. 1 7 1 0
  5455. 2 8 1 0
  5456. 3 9 1 0
  5457. 5 10 1 0
  5458. 6 11 1 0
  5459. M END
  5460. $$$$
  5461. RDKit 3D
  5462. 11 11 0 0 0 0 0 0 0 0999 V2000
  5463. -0.2702 0.2358 1.1283 C 0 0 0 0 0 0 0 0 0 0 0 0
  5464. -1.2785 0.0498 0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0
  5465. -0.9129 -0.2241 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0
  5466. 0.3682 -0.3214 -1.5375 N 0 0 0 0 0 0 0 0 0 0 0 0
  5467. 1.3253 -0.1359 -0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0
  5468. 1.0589 0.1419 0.7289 C 0 0 0 0 0 0 0 0 0 0 0 0
  5469. -0.5180 0.4522 2.1634 H 0 0 0 0 0 0 0 0 0 0 0 0
  5470. -2.3238 0.1164 0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0
  5471. -1.6631 -0.3772 -1.8903 H 0 0 0 0 0 0 0 0 0 0 0 0
  5472. 2.3464 -0.2192 -0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0
  5473. 1.8678 0.2816 1.4368 H 0 0 0 0 0 0 0 0 0 0 0 0
  5474. 1 2 2 0
  5475. 2 3 1 0
  5476. 3 4 2 0
  5477. 4 5 1 0
  5478. 5 6 2 0
  5479. 6 1 1 0
  5480. 1 7 1 0
  5481. 2 8 1 0
  5482. 3 9 1 0
  5483. 5 10 1 0
  5484. 6 11 1 0
  5485. M END
  5486. $$$$
  5487. RDKit 3D
  5488. 11 11 0 0 0 0 0 0 0 0999 V2000
  5489. -0.2702 0.2287 1.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  5490. -1.2785 0.0486 0.1887 C 0 0 0 0 0 0 0 0 0 0 0 0
  5491. -0.9129 -0.2171 -1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0
  5492. 0.3682 -0.3117 -1.5395 N 0 0 0 0 0 0 0 0 0 0 0 0
  5493. 1.3253 -0.1321 -0.6033 C 0 0 0 0 0 0 0 0 0 0 0 0
  5494. 1.0589 0.1373 0.7297 C 0 0 0 0 0 0 0 0 0 0 0 0
  5495. -0.5180 0.4386 2.1662 H 0 0 0 0 0 0 0 0 0 0 0 0
  5496. -2.3238 0.1135 0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0
  5497. -1.6631 -0.3653 -1.8926 H 0 0 0 0 0 0 0 0 0 0 0 0
  5498. 2.3464 -0.2132 -0.9645 H 0 0 0 0 0 0 0 0 0 0 0 0
  5499. 1.8678 0.2726 1.4386 H 0 0 0 0 0 0 0 0 0 0 0 0
  5500. 1 2 2 0
  5501. 2 3 1 0
  5502. 3 4 2 0
  5503. 4 5 1 0
  5504. 5 6 2 0
  5505. 6 1 1 0
  5506. 1 7 1 0
  5507. 2 8 1 0
  5508. 3 9 1 0
  5509. 5 10 1 0
  5510. 6 11 1 0
  5511. M END
  5512. $$$$
  5513. RDKit 3D
  5514. 11 11 0 0 0 0 0 0 0 0999 V2000
  5515. -0.2702 0.2216 1.1311 C 0 0 0 0 0 0 0 0 0 0 0 0
  5516. -1.2785 0.0474 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0
  5517. -0.9129 -0.2100 -1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0
  5518. 0.3682 -0.3020 -1.5414 N 0 0 0 0 0 0 0 0 0 0 0 0
  5519. 1.3253 -0.1283 -0.6041 C 0 0 0 0 0 0 0 0 0 0 0 0
  5520. 1.0589 0.1327 0.7306 C 0 0 0 0 0 0 0 0 0 0 0 0
  5521. -0.5180 0.4250 2.1689 H 0 0 0 0 0 0 0 0 0 0 0 0
  5522. -2.3238 0.1106 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  5523. -1.6631 -0.3534 -1.8949 H 0 0 0 0 0 0 0 0 0 0 0 0
  5524. 2.3464 -0.2071 -0.9658 H 0 0 0 0 0 0 0 0 0 0 0 0
  5525. 1.8678 0.2635 1.4403 H 0 0 0 0 0 0 0 0 0 0 0 0
  5526. 1 2 2 0
  5527. 2 3 1 0
  5528. 3 4 2 0
  5529. 4 5 1 0
  5530. 5 6 2 0
  5531. 6 1 1 0
  5532. 1 7 1 0
  5533. 2 8 1 0
  5534. 3 9 1 0
  5535. 5 10 1 0
  5536. 6 11 1 0
  5537. M END
  5538. $$$$
  5539. RDKit 3D
  5540. 11 11 0 0 0 0 0 0 0 0999 V2000
  5541. -0.2702 0.2145 1.1325 C 0 0 0 0 0 0 0 0 0 0 0 0
  5542. -1.2785 0.0462 0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0
  5543. -0.9129 -0.2029 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0
  5544. 0.3682 -0.2923 -1.5433 N 0 0 0 0 0 0 0 0 0 0 0 0
  5545. 1.3253 -0.1245 -0.6049 C 0 0 0 0 0 0 0 0 0 0 0 0
  5546. 1.0589 0.1281 0.7314 C 0 0 0 0 0 0 0 0 0 0 0 0
  5547. -0.5180 0.4113 2.1715 H 0 0 0 0 0 0 0 0 0 0 0 0
  5548. -2.3238 0.1076 0.4697 H 0 0 0 0 0 0 0 0 0 0 0 0
  5549. -1.6631 -0.3415 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  5550. 2.3464 -0.2010 -0.9671 H 0 0 0 0 0 0 0 0 0 0 0 0
  5551. 1.8678 0.2545 1.4419 H 0 0 0 0 0 0 0 0 0 0 0 0
  5552. 1 2 2 0
  5553. 2 3 1 0
  5554. 3 4 2 0
  5555. 4 5 1 0
  5556. 5 6 2 0
  5557. 6 1 1 0
  5558. 1 7 1 0
  5559. 2 8 1 0
  5560. 3 9 1 0
  5561. 5 10 1 0
  5562. 6 11 1 0
  5563. M END
  5564. $$$$
  5565. RDKit 3D
  5566. 11 11 0 0 0 0 0 0 0 0999 V2000
  5567. -0.2702 0.2074 1.1338 C 0 0 0 0 0 0 0 0 0 0 0 0
  5568. -1.2785 0.0451 0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0
  5569. -0.9129 -0.1959 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
  5570. 0.3682 -0.2826 -1.5451 N 0 0 0 0 0 0 0 0 0 0 0 0
  5571. 1.3253 -0.1207 -0.6056 C 0 0 0 0 0 0 0 0 0 0 0 0
  5572. 1.0589 0.1236 0.7322 C 0 0 0 0 0 0 0 0 0 0 0 0
  5573. -0.5180 0.3977 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0
  5574. -2.3238 0.1047 0.4704 H 0 0 0 0 0 0 0 0 0 0 0 0
  5575. -1.6631 -0.3296 -1.8992 H 0 0 0 0 0 0 0 0 0 0 0 0
  5576. 2.3464 -0.1949 -0.9684 H 0 0 0 0 0 0 0 0 0 0 0 0
  5577. 1.8678 0.2454 1.4435 H 0 0 0 0 0 0 0 0 0 0 0 0
  5578. 1 2 2 0
  5579. 2 3 1 0
  5580. 3 4 2 0
  5581. 4 5 1 0
  5582. 5 6 2 0
  5583. 6 1 1 0
  5584. 1 7 1 0
  5585. 2 8 1 0
  5586. 3 9 1 0
  5587. 5 10 1 0
  5588. 6 11 1 0
  5589. M END
  5590. $$$$
  5591. RDKit 3D
  5592. 11 11 0 0 0 0 0 0 0 0999 V2000
  5593. -0.2702 0.2003 1.1351 C 0 0 0 0 0 0 0 0 0 0 0 0
  5594. -1.2785 0.0439 0.1899 C 0 0 0 0 0 0 0 0 0 0 0 0
  5595. -0.9129 -0.1888 -1.1264 C 0 0 0 0 0 0 0 0 0 0 0 0
  5596. 0.3682 -0.2729 -1.5468 N 0 0 0 0 0 0 0 0 0 0 0 0
  5597. 1.3253 -0.1169 -0.6064 C 0 0 0 0 0 0 0 0 0 0 0 0
  5598. 1.0589 0.1189 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0
  5599. -0.5180 0.3840 2.1765 H 0 0 0 0 0 0 0 0 0 0 0 0
  5600. -2.3238 0.1017 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
  5601. -1.6631 -0.3176 -1.9012 H 0 0 0 0 0 0 0 0 0 0 0 0
  5602. 2.3464 -0.1888 -0.9696 H 0 0 0 0 0 0 0 0 0 0 0 0
  5603. 1.8678 0.2363 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  5604. 1 2 2 0
  5605. 2 3 1 0
  5606. 3 4 2 0
  5607. 4 5 1 0
  5608. 5 6 2 0
  5609. 6 1 1 0
  5610. 1 7 1 0
  5611. 2 8 1 0
  5612. 3 9 1 0
  5613. 5 10 1 0
  5614. 6 11 1 0
  5615. M END
  5616. $$$$
  5617. RDKit 3D
  5618. 11 11 0 0 0 0 0 0 0 0999 V2000
  5619. -0.2702 0.1931 1.1363 C 0 0 0 0 0 0 0 0 0 0 0 0
  5620. -1.2785 0.0427 0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0
  5621. -0.9129 -0.1817 -1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
  5622. 0.3682 -0.2632 -1.5485 N 0 0 0 0 0 0 0 0 0 0 0 0
  5623. 1.3253 -0.1131 -0.6071 C 0 0 0 0 0 0 0 0 0 0 0 0
  5624. 1.0589 0.1143 0.7337 C 0 0 0 0 0 0 0 0 0 0 0 0
  5625. -0.5180 0.3703 2.1789 H 0 0 0 0 0 0 0 0 0 0 0 0
  5626. -2.3238 0.0987 0.4717 H 0 0 0 0 0 0 0 0 0 0 0 0
  5627. -1.6631 -0.3057 -1.9031 H 0 0 0 0 0 0 0 0 0 0 0 0
  5628. 2.3464 -0.1828 -0.9707 H 0 0 0 0 0 0 0 0 0 0 0 0
  5629. 1.8678 0.2273 1.4464 H 0 0 0 0 0 0 0 0 0 0 0 0
  5630. 1 2 2 0
  5631. 2 3 1 0
  5632. 3 4 2 0
  5633. 4 5 1 0
  5634. 5 6 2 0
  5635. 6 1 1 0
  5636. 1 7 1 0
  5637. 2 8 1 0
  5638. 3 9 1 0
  5639. 5 10 1 0
  5640. 6 11 1 0
  5641. M END
  5642. $$$$
  5643. RDKit 3D
  5644. 11 11 0 0 0 0 0 0 0 0999 V2000
  5645. -0.2702 0.1860 1.1375 C 0 0 0 0 0 0 0 0 0 0 0 0
  5646. -1.2785 0.0415 0.1904 C 0 0 0 0 0 0 0 0 0 0 0 0
  5647. -0.9129 -0.1746 -1.1287 C 0 0 0 0 0 0 0 0 0 0 0 0
  5648. 0.3682 -0.2535 -1.5501 N 0 0 0 0 0 0 0 0 0 0 0 0
  5649. 1.3253 -0.1093 -0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0
  5650. 1.0589 0.1097 0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0
  5651. -0.5180 0.3566 2.1811 H 0 0 0 0 0 0 0 0 0 0 0 0
  5652. -2.3238 0.0958 0.4723 H 0 0 0 0 0 0 0 0 0 0 0 0
  5653. -1.6631 -0.2937 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0
  5654. 2.3464 -0.1766 -0.9719 H 0 0 0 0 0 0 0 0 0 0 0 0
  5655. 1.8678 0.2182 1.4478 H 0 0 0 0 0 0 0 0 0 0 0 0
  5656. 1 2 2 0
  5657. 2 3 1 0
  5658. 3 4 2 0
  5659. 4 5 1 0
  5660. 5 6 2 0
  5661. 6 1 1 0
  5662. 1 7 1 0
  5663. 2 8 1 0
  5664. 3 9 1 0
  5665. 5 10 1 0
  5666. 6 11 1 0
  5667. M END
  5668. $$$$
  5669. RDKit 3D
  5670. 11 11 0 0 0 0 0 0 0 0999 V2000
  5671. -0.2702 0.1788 1.1387 C 0 0 0 0 0 0 0 0 0 0 0 0
  5672. -1.2785 0.0403 0.1906 C 0 0 0 0 0 0 0 0 0 0 0 0
  5673. -0.9129 -0.1675 -1.1298 C 0 0 0 0 0 0 0 0 0 0 0 0
  5674. 0.3682 -0.2437 -1.5517 N 0 0 0 0 0 0 0 0 0 0 0 0
  5675. 1.3253 -0.1055 -0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0
  5676. 1.0589 0.1051 0.7351 C 0 0 0 0 0 0 0 0 0 0 0 0
  5677. -0.5180 0.3429 2.1833 H 0 0 0 0 0 0 0 0 0 0 0 0
  5678. -2.3238 0.0928 0.4729 H 0 0 0 0 0 0 0 0 0 0 0 0
  5679. -1.6631 -0.2817 -1.9068 H 0 0 0 0 0 0 0 0 0 0 0 0
  5680. 2.3464 -0.1705 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0
  5681. 1.8678 0.2091 1.4492 H 0 0 0 0 0 0 0 0 0 0 0 0
  5682. 1 2 2 0
  5683. 2 3 1 0
  5684. 3 4 2 0
  5685. 4 5 1 0
  5686. 5 6 2 0
  5687. 6 1 1 0
  5688. 1 7 1 0
  5689. 2 8 1 0
  5690. 3 9 1 0
  5691. 5 10 1 0
  5692. 6 11 1 0
  5693. M END
  5694. $$$$
  5695. RDKit 3D
  5696. 11 11 0 0 0 0 0 0 0 0999 V2000
  5697. -0.2702 0.1717 1.1398 C 0 0 0 0 0 0 0 0 0 0 0 0
  5698. -1.2785 0.0391 0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0
  5699. -0.9129 -0.1604 -1.1308 C 0 0 0 0 0 0 0 0 0 0 0 0
  5700. 0.3682 -0.2340 -1.5532 N 0 0 0 0 0 0 0 0 0 0 0 0
  5701. 1.3253 -0.1016 -0.6091 C 0 0 0 0 0 0 0 0 0 0 0 0
  5702. 1.0589 0.1005 0.7357 C 0 0 0 0 0 0 0 0 0 0 0 0
  5703. -0.5180 0.3292 2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0
  5704. -2.3238 0.0898 0.4735 H 0 0 0 0 0 0 0 0 0 0 0 0
  5705. -1.6631 -0.2698 -1.9086 H 0 0 0 0 0 0 0 0 0 0 0 0
  5706. 2.3464 -0.1644 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0
  5707. 1.8678 0.2000 1.4504 H 0 0 0 0 0 0 0 0 0 0 0 0
  5708. 1 2 2 0
  5709. 2 3 1 0
  5710. 3 4 2 0
  5711. 4 5 1 0
  5712. 5 6 2 0
  5713. 6 1 1 0
  5714. 1 7 1 0
  5715. 2 8 1 0
  5716. 3 9 1 0
  5717. 5 10 1 0
  5718. 6 11 1 0
  5719. M END
  5720. $$$$
  5721. RDKit 3D
  5722. 11 11 0 0 0 0 0 0 0 0999 V2000
  5723. -0.2702 0.1645 1.1408 C 0 0 0 0 0 0 0 0 0 0 0 0
  5724. -1.2785 0.0379 0.1911 C 0 0 0 0 0 0 0 0 0 0 0 0
  5725. -0.9129 -0.1533 -1.1318 C 0 0 0 0 0 0 0 0 0 0 0 0
  5726. 0.3682 -0.2242 -1.5546 N 0 0 0 0 0 0 0 0 0 0 0 0
  5727. 1.3253 -0.0978 -0.6098 C 0 0 0 0 0 0 0 0 0 0 0 0
  5728. 1.0589 0.0959 0.7363 C 0 0 0 0 0 0 0 0 0 0 0 0
  5729. -0.5180 0.3154 2.1875 H 0 0 0 0 0 0 0 0 0 0 0 0
  5730. -2.3238 0.0869 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0
  5731. -1.6631 -0.2578 -1.9102 H 0 0 0 0 0 0 0 0 0 0 0 0
  5732. 2.3464 -0.1583 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0
  5733. 1.8678 0.1908 1.4517 H 0 0 0 0 0 0 0 0 0 0 0 0
  5734. 1 2 2 0
  5735. 2 3 1 0
  5736. 3 4 2 0
  5737. 4 5 1 0
  5738. 5 6 2 0
  5739. 6 1 1 0
  5740. 1 7 1 0
  5741. 2 8 1 0
  5742. 3 9 1 0
  5743. 5 10 1 0
  5744. 6 11 1 0
  5745. M END
  5746. $$$$
  5747. RDKit 3D
  5748. 11 11 0 0 0 0 0 0 0 0999 V2000
  5749. -0.2702 0.1573 1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  5750. -1.2785 0.0367 0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0
  5751. -0.9129 -0.1462 -1.1328 C 0 0 0 0 0 0 0 0 0 0 0 0
  5752. 0.3682 -0.2144 -1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0
  5753. 1.3253 -0.0940 -0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0
  5754. 1.0589 0.0912 0.7369 C 0 0 0 0 0 0 0 0 0 0 0 0
  5755. -0.5180 0.3017 2.1894 H 0 0 0 0 0 0 0 0 0 0 0 0
  5756. -2.3238 0.0839 0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0
  5757. -1.6631 -0.2458 -1.9118 H 0 0 0 0 0 0 0 0 0 0 0 0
  5758. 2.3464 -0.1522 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5759. 1.8678 0.1817 1.4528 H 0 0 0 0 0 0 0 0 0 0 0 0
  5760. 1 2 2 0
  5761. 2 3 1 0
  5762. 3 4 2 0
  5763. 4 5 1 0
  5764. 5 6 2 0
  5765. 6 1 1 0
  5766. 1 7 1 0
  5767. 2 8 1 0
  5768. 3 9 1 0
  5769. 5 10 1 0
  5770. 6 11 1 0
  5771. M END
  5772. $$$$
  5773. RDKit 3D
  5774. 11 11 0 0 0 0 0 0 0 0999 V2000
  5775. -0.2702 0.1502 1.1428 C 0 0 0 0 0 0 0 0 0 0 0 0
  5776. -1.2785 0.0355 0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0
  5777. -0.9129 -0.1391 -1.1337 C 0 0 0 0 0 0 0 0 0 0 0 0
  5778. 0.3682 -0.2046 -1.5573 N 0 0 0 0 0 0 0 0 0 0 0 0
  5779. 1.3253 -0.0901 -0.6109 C 0 0 0 0 0 0 0 0 0 0 0 0
  5780. 1.0589 0.0866 0.7375 C 0 0 0 0 0 0 0 0 0 0 0 0
  5781. -0.5180 0.2879 2.1913 H 0 0 0 0 0 0 0 0 0 0 0 0
  5782. -2.3238 0.0809 0.4751 H 0 0 0 0 0 0 0 0 0 0 0 0
  5783. -1.6631 -0.2337 -1.9133 H 0 0 0 0 0 0 0 0 0 0 0 0
  5784. 2.3464 -0.1460 -0.9769 H 0 0 0 0 0 0 0 0 0 0 0 0
  5785. 1.8678 0.1726 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
  5786. 1 2 2 0
  5787. 2 3 1 0
  5788. 3 4 2 0
  5789. 4 5 1 0
  5790. 5 6 2 0
  5791. 6 1 1 0
  5792. 1 7 1 0
  5793. 2 8 1 0
  5794. 3 9 1 0
  5795. 5 10 1 0
  5796. 6 11 1 0
  5797. M END
  5798. $$$$
  5799. RDKit 3D
  5800. 11 11 0 0 0 0 0 0 0 0999 V2000
  5801. -0.2702 0.1430 1.1437 C 0 0 0 0 0 0 0 0 0 0 0 0
  5802. -1.2785 0.0343 0.1918 C 0 0 0 0 0 0 0 0 0 0 0 0
  5803. -0.9129 -0.1320 -1.1345 C 0 0 0 0 0 0 0 0 0 0 0 0
  5804. 0.3682 -0.1948 -1.5586 N 0 0 0 0 0 0 0 0 0 0 0 0
  5805. 1.3253 -0.0863 -0.6115 C 0 0 0 0 0 0 0 0 0 0 0 0
  5806. 1.0589 0.0820 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0
  5807. -0.5180 0.2742 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0
  5808. -2.3238 0.0779 0.4756 H 0 0 0 0 0 0 0 0 0 0 0 0
  5809. -1.6631 -0.2217 -1.9147 H 0 0 0 0 0 0 0 0 0 0 0 0
  5810. 2.3464 -0.1399 -0.9778 H 0 0 0 0 0 0 0 0 0 0 0 0
  5811. 1.8678 0.1634 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0
  5812. 1 2 2 0
  5813. 2 3 1 0
  5814. 3 4 2 0
  5815. 4 5 1 0
  5816. 5 6 2 0
  5817. 6 1 1 0
  5818. 1 7 1 0
  5819. 2 8 1 0
  5820. 3 9 1 0
  5821. 5 10 1 0
  5822. 6 11 1 0
  5823. M END
  5824. $$$$
  5825. RDKit 3D
  5826. 11 11 0 0 0 0 0 0 0 0999 V2000
  5827. -0.2702 0.1358 1.1446 C 0 0 0 0 0 0 0 0 0 0 0 0
  5828. -1.2785 0.0331 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0
  5829. -0.9129 -0.1248 -1.1353 C 0 0 0 0 0 0 0 0 0 0 0 0
  5830. 0.3682 -0.1850 -1.5598 N 0 0 0 0 0 0 0 0 0 0 0 0
  5831. 1.3253 -0.0825 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0
  5832. 1.0589 0.0773 0.7385 C 0 0 0 0 0 0 0 0 0 0 0 0
  5833. -0.5180 0.2604 2.1947 H 0 0 0 0 0 0 0 0 0 0 0 0
  5834. -2.3238 0.0749 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5835. -1.6631 -0.2097 -1.9161 H 0 0 0 0 0 0 0 0 0 0 0 0
  5836. 2.3464 -0.1337 -0.9787 H 0 0 0 0 0 0 0 0 0 0 0 0
  5837. 1.8678 0.1543 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0
  5838. 1 2 2 0
  5839. 2 3 1 0
  5840. 3 4 2 0
  5841. 4 5 1 0
  5842. 5 6 2 0
  5843. 6 1 1 0
  5844. 1 7 1 0
  5845. 2 8 1 0
  5846. 3 9 1 0
  5847. 5 10 1 0
  5848. 6 11 1 0
  5849. M END
  5850. $$$$
  5851. RDKit 3D
  5852. 11 11 0 0 0 0 0 0 0 0999 V2000
  5853. -0.2702 0.1286 1.1454 C 0 0 0 0 0 0 0 0 0 0 0 0
  5854. -1.2785 0.0319 0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0
  5855. -0.9129 -0.1177 -1.1361 C 0 0 0 0 0 0 0 0 0 0 0 0
  5856. 0.3682 -0.1752 -1.5609 N 0 0 0 0 0 0 0 0 0 0 0 0
  5857. 1.3253 -0.0786 -0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0
  5858. 1.0589 0.0727 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0
  5859. -0.5180 0.2466 2.1963 H 0 0 0 0 0 0 0 0 0 0 0 0
  5860. -2.3238 0.0719 0.4765 H 0 0 0 0 0 0 0 0 0 0 0 0
  5861. -1.6631 -0.1976 -1.9174 H 0 0 0 0 0 0 0 0 0 0 0 0
  5862. 2.3464 -0.1276 -0.9795 H 0 0 0 0 0 0 0 0 0 0 0 0
  5863. 1.8678 0.1452 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5864. 1 2 2 0
  5865. 2 3 1 0
  5866. 3 4 2 0
  5867. 4 5 1 0
  5868. 5 6 2 0
  5869. 6 1 1 0
  5870. 1 7 1 0
  5871. 2 8 1 0
  5872. 3 9 1 0
  5873. 5 10 1 0
  5874. 6 11 1 0
  5875. M END
  5876. $$$$
  5877. RDKit 3D
  5878. 11 11 0 0 0 0 0 0 0 0999 V2000
  5879. -0.2702 0.1214 1.1462 C 0 0 0 0 0 0 0 0 0 0 0 0
  5880. -1.2785 0.0306 0.1924 C 0 0 0 0 0 0 0 0 0 0 0 0
  5881. -0.9129 -0.1106 -1.1368 C 0 0 0 0 0 0 0 0 0 0 0 0
  5882. 0.3682 -0.1654 -1.5620 N 0 0 0 0 0 0 0 0 0 0 0 0
  5883. 1.3253 -0.0748 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0
  5884. 1.0589 0.0680 0.7394 C 0 0 0 0 0 0 0 0 0 0 0 0
  5885. -0.5180 0.2328 2.1978 H 0 0 0 0 0 0 0 0 0 0 0 0
  5886. -2.3238 0.0689 0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
  5887. -1.6631 -0.1856 -1.9186 H 0 0 0 0 0 0 0 0 0 0 0 0
  5888. 2.3464 -0.1214 -0.9803 H 0 0 0 0 0 0 0 0 0 0 0 0
  5889. 1.8678 0.1360 1.4578 H 0 0 0 0 0 0 0 0 0 0 0 0
  5890. 1 2 2 0
  5891. 2 3 1 0
  5892. 3 4 2 0
  5893. 4 5 1 0
  5894. 5 6 2 0
  5895. 6 1 1 0
  5896. 1 7 1 0
  5897. 2 8 1 0
  5898. 3 9 1 0
  5899. 5 10 1 0
  5900. 6 11 1 0
  5901. M END
  5902. $$$$
  5903. RDKit 3D
  5904. 11 11 0 0 0 0 0 0 0 0999 V2000
  5905. -0.2702 0.1142 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  5906. -1.2785 0.0294 0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0
  5907. -0.9129 -0.1034 -1.1375 C 0 0 0 0 0 0 0 0 0 0 0 0
  5908. 0.3682 -0.1556 -1.5630 N 0 0 0 0 0 0 0 0 0 0 0 0
  5909. 1.3253 -0.0709 -0.6135 C 0 0 0 0 0 0 0 0 0 0 0 0
  5910. 1.0589 0.0634 0.7398 C 0 0 0 0 0 0 0 0 0 0 0 0
  5911. -0.5180 0.2190 2.1992 H 0 0 0 0 0 0 0 0 0 0 0 0
  5912. -2.3238 0.0659 0.4774 H 0 0 0 0 0 0 0 0 0 0 0 0
  5913. -1.6631 -0.1735 -1.9197 H 0 0 0 0 0 0 0 0 0 0 0 0
  5914. 2.3464 -0.1153 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0
  5915. 1.8678 0.1268 1.4587 H 0 0 0 0 0 0 0 0 0 0 0 0
  5916. 1 2 2 0
  5917. 2 3 1 0
  5918. 3 4 2 0
  5919. 4 5 1 0
  5920. 5 6 2 0
  5921. 6 1 1 0
  5922. 1 7 1 0
  5923. 2 8 1 0
  5924. 3 9 1 0
  5925. 5 10 1 0
  5926. 6 11 1 0
  5927. M END
  5928. $$$$
  5929. RDKit 3D
  5930. 11 11 0 0 0 0 0 0 0 0999 V2000
  5931. -0.2702 0.1070 1.1477 C 0 0 0 0 0 0 0 0 0 0 0 0
  5932. -1.2785 0.0282 0.1928 C 0 0 0 0 0 0 0 0 0 0 0 0
  5933. -0.9129 -0.0963 -1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0
  5934. 0.3682 -0.1458 -1.5639 N 0 0 0 0 0 0 0 0 0 0 0 0
  5935. 1.3253 -0.0670 -0.6139 C 0 0 0 0 0 0 0 0 0 0 0 0
  5936. 1.0589 0.0587 0.7402 C 0 0 0 0 0 0 0 0 0 0 0 0
  5937. -0.5180 0.2051 2.2006 H 0 0 0 0 0 0 0 0 0 0 0 0
  5938. -2.3238 0.0629 0.4778 H 0 0 0 0 0 0 0 0 0 0 0 0
  5939. -1.6631 -0.1615 -1.9208 H 0 0 0 0 0 0 0 0 0 0 0 0
  5940. 2.3464 -0.1091 -0.9817 H 0 0 0 0 0 0 0 0 0 0 0 0
  5941. 1.8678 0.1177 1.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
  5942. 1 2 2 0
  5943. 2 3 1 0
  5944. 3 4 2 0
  5945. 4 5 1 0
  5946. 5 6 2 0
  5947. 6 1 1 0
  5948. 1 7 1 0
  5949. 2 8 1 0
  5950. 3 9 1 0
  5951. 5 10 1 0
  5952. 6 11 1 0
  5953. M END
  5954. $$$$
  5955. RDKit 3D
  5956. 11 11 0 0 0 0 0 0 0 0999 V2000
  5957. -0.2702 0.0998 1.1483 C 0 0 0 0 0 0 0 0 0 0 0 0
  5958. -1.2785 0.0270 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0
  5959. -0.9129 -0.0891 -1.1387 C 0 0 0 0 0 0 0 0 0 0 0 0
  5960. 0.3682 -0.1360 -1.5648 N 0 0 0 0 0 0 0 0 0 0 0 0
  5961. 1.3253 -0.0632 -0.6143 C 0 0 0 0 0 0 0 0 0 0 0 0
  5962. 1.0589 0.0541 0.7406 C 0 0 0 0 0 0 0 0 0 0 0 0
  5963. -0.5180 0.1913 2.2018 H 0 0 0 0 0 0 0 0 0 0 0 0
  5964. -2.3238 0.0599 0.4782 H 0 0 0 0 0 0 0 0 0 0 0 0
  5965. -1.6631 -0.1494 -1.9217 H 0 0 0 0 0 0 0 0 0 0 0 0
  5966. 2.3464 -0.1029 -0.9824 H 0 0 0 0 0 0 0 0 0 0 0 0
  5967. 1.8678 0.1085 1.4601 H 0 0 0 0 0 0 0 0 0 0 0 0
  5968. 1 2 2 0
  5969. 2 3 1 0
  5970. 3 4 2 0
  5971. 4 5 1 0
  5972. 5 6 2 0
  5973. 6 1 1 0
  5974. 1 7 1 0
  5975. 2 8 1 0
  5976. 3 9 1 0
  5977. 5 10 1 0
  5978. 6 11 1 0
  5979. M END
  5980. $$$$
  5981. RDKit 3D
  5982. 11 11 0 0 0 0 0 0 0 0999 V2000
  5983. -0.2702 0.0926 1.1489 C 0 0 0 0 0 0 0 0 0 0 0 0
  5984. -1.2785 0.0258 0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0
  5985. -0.9129 -0.0820 -1.1392 C 0 0 0 0 0 0 0 0 0 0 0 0
  5986. 0.3682 -0.1261 -1.5657 N 0 0 0 0 0 0 0 0 0 0 0 0
  5987. 1.3253 -0.0593 -0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0
  5988. 1.0589 0.0494 0.7409 C 0 0 0 0 0 0 0 0 0 0 0 0
  5989. -0.5180 0.1775 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0
  5990. -2.3238 0.0569 0.4785 H 0 0 0 0 0 0 0 0 0 0 0 0
  5991. -1.6631 -0.1373 -1.9226 H 0 0 0 0 0 0 0 0 0 0 0 0
  5992. 2.3464 -0.0968 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0
  5993. 1.8678 0.0993 1.4608 H 0 0 0 0 0 0 0 0 0 0 0 0
  5994. 1 2 2 0
  5995. 2 3 1 0
  5996. 3 4 2 0
  5997. 4 5 1 0
  5998. 5 6 2 0
  5999. 6 1 1 0
  6000. 1 7 1 0
  6001. 2 8 1 0
  6002. 3 9 1 0
  6003. 5 10 1 0
  6004. 6 11 1 0
  6005. M END
  6006. $$$$
  6007. RDKit 3D
  6008. 11 11 0 0 0 0 0 0 0 0999 V2000
  6009. -0.2702 0.0853 1.1495 C 0 0 0 0 0 0 0 0 0 0 0 0
  6010. -1.2785 0.0246 0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0
  6011. -0.9129 -0.0748 -1.1397 C 0 0 0 0 0 0 0 0 0 0 0 0
  6012. 0.3682 -0.1163 -1.5664 N 0 0 0 0 0 0 0 0 0 0 0 0
  6013. 1.3253 -0.0555 -0.6151 C 0 0 0 0 0 0 0 0 0 0 0 0
  6014. 1.0589 0.0448 0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0
  6015. -0.5180 0.1636 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
  6016. -2.3238 0.0539 0.4789 H 0 0 0 0 0 0 0 0 0 0 0 0
  6017. -1.6631 -0.1252 -1.9235 H 0 0 0 0 0 0 0 0 0 0 0 0
  6018. 2.3464 -0.0906 -0.9836 H 0 0 0 0 0 0 0 0 0 0 0 0
  6019. 1.8678 0.0901 1.4614 H 0 0 0 0 0 0 0 0 0 0 0 0
  6020. 1 2 2 0
  6021. 2 3 1 0
  6022. 3 4 2 0
  6023. 4 5 1 0
  6024. 5 6 2 0
  6025. 6 1 1 0
  6026. 1 7 1 0
  6027. 2 8 1 0
  6028. 3 9 1 0
  6029. 5 10 1 0
  6030. 6 11 1 0
  6031. M END
  6032. $$$$
  6033. RDKit 3D
  6034. 11 11 0 0 0 0 0 0 0 0999 V2000
  6035. -0.2702 0.0781 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
  6036. -1.2785 0.0234 0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0
  6037. -0.9129 -0.0676 -1.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
  6038. 0.3682 -0.1064 -1.5671 N 0 0 0 0 0 0 0 0 0 0 0 0
  6039. 1.3253 -0.0516 -0.6154 C 0 0 0 0 0 0 0 0 0 0 0 0
  6040. 1.0589 0.0401 0.7415 C 0 0 0 0 0 0 0 0 0 0 0 0
  6041. -0.5180 0.1498 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  6042. -2.3238 0.0509 0.4792 H 0 0 0 0 0 0 0 0 0 0 0 0
  6043. -1.6631 -0.1131 -1.9242 H 0 0 0 0 0 0 0 0 0 0 0 0
  6044. 2.3464 -0.0844 -0.9842 H 0 0 0 0 0 0 0 0 0 0 0 0
  6045. 1.8678 0.0810 1.4619 H 0 0 0 0 0 0 0 0 0 0 0 0
  6046. 1 2 2 0
  6047. 2 3 1 0
  6048. 3 4 2 0
  6049. 4 5 1 0
  6050. 5 6 2 0
  6051. 6 1 1 0
  6052. 1 7 1 0
  6053. 2 8 1 0
  6054. 3 9 1 0
  6055. 5 10 1 0
  6056. 6 11 1 0
  6057. M END
  6058. $$$$
  6059. RDKit 3D
  6060. 11 11 0 0 0 0 0 0 0 0999 V2000
  6061. -0.2702 0.0709 1.1505 C 0 0 0 0 0 0 0 0 0 0 0 0
  6062. -1.2785 0.0222 0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0
  6063. -0.9129 -0.0605 -1.1406 C 0 0 0 0 0 0 0 0 0 0 0 0
  6064. 0.3682 -0.0966 -1.5678 N 0 0 0 0 0 0 0 0 0 0 0 0
  6065. 1.3253 -0.0477 -0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0
  6066. 1.0589 0.0355 0.7417 C 0 0 0 0 0 0 0 0 0 0 0 0
  6067. -0.5180 0.1359 2.2059 H 0 0 0 0 0 0 0 0 0 0 0 0
  6068. -2.3238 0.0479 0.4795 H 0 0 0 0 0 0 0 0 0 0 0 0
  6069. -1.6631 -0.1010 -1.9249 H 0 0 0 0 0 0 0 0 0 0 0 0
  6070. 2.3464 -0.0782 -0.9847 H 0 0 0 0 0 0 0 0 0 0 0 0
  6071. 1.8678 0.0718 1.4624 H 0 0 0 0 0 0 0 0 0 0 0 0
  6072. 1 2 2 0
  6073. 2 3 1 0
  6074. 3 4 2 0
  6075. 4 5 1 0
  6076. 5 6 2 0
  6077. 6 1 1 0
  6078. 1 7 1 0
  6079. 2 8 1 0
  6080. 3 9 1 0
  6081. 5 10 1 0
  6082. 6 11 1 0
  6083. M END
  6084. $$$$
  6085. RDKit 3D
  6086. 11 11 0 0 0 0 0 0 0 0999 V2000
  6087. -0.2702 0.0637 1.1509 C 0 0 0 0 0 0 0 0 0 0 0 0
  6088. -1.2785 0.0209 0.1937 C 0 0 0 0 0 0 0 0 0 0 0 0
  6089. -0.9129 -0.0533 -1.1409 C 0 0 0 0 0 0 0 0 0 0 0 0
  6090. 0.3682 -0.0867 -1.5683 N 0 0 0 0 0 0 0 0 0 0 0 0
  6091. 1.3253 -0.0439 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0
  6092. 1.0589 0.0308 0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0
  6093. -0.5180 0.1221 2.2067 H 0 0 0 0 0 0 0 0 0 0 0 0
  6094. -2.3238 0.0449 0.4798 H 0 0 0 0 0 0 0 0 0 0 0 0
  6095. -1.6631 -0.0890 -1.9255 H 0 0 0 0 0 0 0 0 0 0 0 0
  6096. 2.3464 -0.0720 -0.9852 H 0 0 0 0 0 0 0 0 0 0 0 0
  6097. 1.8678 0.0626 1.4628 H 0 0 0 0 0 0 0 0 0 0 0 0
  6098. 1 2 2 0
  6099. 2 3 1 0
  6100. 3 4 2 0
  6101. 4 5 1 0
  6102. 5 6 2 0
  6103. 6 1 1 0
  6104. 1 7 1 0
  6105. 2 8 1 0
  6106. 3 9 1 0
  6107. 5 10 1 0
  6108. 6 11 1 0
  6109. M END
  6110. $$$$
  6111. RDKit 3D
  6112. 11 11 0 0 0 0 0 0 0 0999 V2000
  6113. -0.2702 0.0564 1.1513 C 0 0 0 0 0 0 0 0 0 0 0 0
  6114. -1.2785 0.0197 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0
  6115. -0.9129 -0.0461 -1.1412 C 0 0 0 0 0 0 0 0 0 0 0 0
  6116. 0.3682 -0.0769 -1.5688 N 0 0 0 0 0 0 0 0 0 0 0 0
  6117. 1.3253 -0.0400 -0.6163 C 0 0 0 0 0 0 0 0 0 0 0 0
  6118. 1.0589 0.0261 0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0
  6119. -0.5180 0.1082 2.2075 H 0 0 0 0 0 0 0 0 0 0 0 0
  6120. -2.3238 0.0419 0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0
  6121. -1.6631 -0.0769 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
  6122. 2.3464 -0.0658 -0.9856 H 0 0 0 0 0 0 0 0 0 0 0 0
  6123. 1.8678 0.0534 1.4632 H 0 0 0 0 0 0 0 0 0 0 0 0
  6124. 1 2 2 0
  6125. 2 3 1 0
  6126. 3 4 2 0
  6127. 4 5 1 0
  6128. 5 6 2 0
  6129. 6 1 1 0
  6130. 1 7 1 0
  6131. 2 8 1 0
  6132. 3 9 1 0
  6133. 5 10 1 0
  6134. 6 11 1 0
  6135. M END
  6136. $$$$
  6137. RDKit 3D
  6138. 11 11 0 0 0 0 0 0 0 0999 V2000
  6139. -0.2702 0.0492 1.1516 C 0 0 0 0 0 0 0 0 0 0 0 0
  6140. -1.2785 0.0185 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0
  6141. -0.9129 -0.0390 -1.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
  6142. 0.3682 -0.0670 -1.5693 N 0 0 0 0 0 0 0 0 0 0 0 0
  6143. 1.3253 -0.0361 -0.6165 C 0 0 0 0 0 0 0 0 0 0 0 0
  6144. 1.0589 0.0215 0.7422 C 0 0 0 0 0 0 0 0 0 0 0 0
  6145. -0.5180 0.0943 2.2081 H 0 0 0 0 0 0 0 0 0 0 0 0
  6146. -2.3238 0.0388 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
  6147. -1.6631 -0.0647 -1.9264 H 0 0 0 0 0 0 0 0 0 0 0 0
  6148. 2.3464 -0.0596 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0
  6149. 1.8678 0.0442 1.4635 H 0 0 0 0 0 0 0 0 0 0 0 0
  6150. 1 2 2 0
  6151. 2 3 1 0
  6152. 3 4 2 0
  6153. 4 5 1 0
  6154. 5 6 2 0
  6155. 6 1 1 0
  6156. 1 7 1 0
  6157. 2 8 1 0
  6158. 3 9 1 0
  6159. 5 10 1 0
  6160. 6 11 1 0
  6161. M END
  6162. $$$$
  6163. RDKit 3D
  6164. 11 11 0 0 0 0 0 0 0 0999 V2000
  6165. -0.2702 0.0419 1.1519 C 0 0 0 0 0 0 0 0 0 0 0 0
  6166. -1.2785 0.0173 0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
  6167. -0.9129 -0.0318 -1.1417 C 0 0 0 0 0 0 0 0 0 0 0 0
  6168. 0.3682 -0.0572 -1.5697 N 0 0 0 0 0 0 0 0 0 0 0 0
  6169. 1.3253 -0.0322 -0.6167 C 0 0 0 0 0 0 0 0 0 0 0 0
  6170. 1.0589 0.0168 0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0
  6171. -0.5180 0.0804 2.2086 H 0 0 0 0 0 0 0 0 0 0 0 0
  6172. -2.3238 0.0358 0.4806 H 0 0 0 0 0 0 0 0 0 0 0 0
  6173. -1.6631 -0.0526 -1.9268 H 0 0 0 0 0 0 0 0 0 0 0 0
  6174. 2.3464 -0.0535 -0.9863 H 0 0 0 0 0 0 0 0 0 0 0 0
  6175. 1.8678 0.0350 1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  6176. 1 2 2 0
  6177. 2 3 1 0
  6178. 3 4 2 0
  6179. 4 5 1 0
  6180. 5 6 2 0
  6181. 6 1 1 0
  6182. 1 7 1 0
  6183. 2 8 1 0
  6184. 3 9 1 0
  6185. 5 10 1 0
  6186. 6 11 1 0
  6187. M END
  6188. $$$$
  6189. RDKit 3D
  6190. 11 11 0 0 0 0 0 0 0 0999 V2000
  6191. -0.2702 0.0347 1.1521 C 0 0 0 0 0 0 0 0 0 0 0 0
  6192. -1.2785 0.0161 0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0
  6193. -0.9129 -0.0246 -1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  6194. 0.3682 -0.0473 -1.5700 N 0 0 0 0 0 0 0 0 0 0 0 0
  6195. 1.3253 -0.0284 -0.6169 C 0 0 0 0 0 0 0 0 0 0 0 0
  6196. 1.0589 0.0122 0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0
  6197. -0.5180 0.0666 2.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
  6198. -2.3238 0.0328 0.4808 H 0 0 0 0 0 0 0 0 0 0 0 0
  6199. -1.6631 -0.0405 -1.9271 H 0 0 0 0 0 0 0 0 0 0 0 0
  6200. 2.3464 -0.0473 -0.9867 H 0 0 0 0 0 0 0 0 0 0 0 0
  6201. 1.8678 0.0258 1.4639 H 0 0 0 0 0 0 0 0 0 0 0 0
  6202. 1 2 2 0
  6203. 2 3 1 0
  6204. 3 4 2 0
  6205. 4 5 1 0
  6206. 5 6 2 0
  6207. 6 1 1 0
  6208. 1 7 1 0
  6209. 2 8 1 0
  6210. 3 9 1 0
  6211. 5 10 1 0
  6212. 6 11 1 0
  6213. M END
  6214. $$$$
  6215. RDKit 3D
  6216. 11 11 0 0 0 0 0 0 0 0999 V2000
  6217. -0.2702 0.0275 1.1523 C 0 0 0 0 0 0 0 0 0 0 0 0
  6218. -1.2785 0.0148 0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0
  6219. -0.9129 -0.0174 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0
  6220. 0.3682 -0.0374 -1.5703 N 0 0 0 0 0 0 0 0 0 0 0 0
  6221. 1.3253 -0.0245 -0.6171 C 0 0 0 0 0 0 0 0 0 0 0 0
  6222. 1.0589 0.0075 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  6223. -0.5180 0.0527 2.2095 H 0 0 0 0 0 0 0 0 0 0 0 0
  6224. -2.3238 0.0298 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0
  6225. -1.6631 -0.0284 -1.9273 H 0 0 0 0 0 0 0 0 0 0 0 0
  6226. 2.3464 -0.0411 -0.9869 H 0 0 0 0 0 0 0 0 0 0 0 0
  6227. 1.8678 0.0166 1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
  6228. 1 2 2 0
  6229. 2 3 1 0
  6230. 3 4 2 0
  6231. 4 5 1 0
  6232. 5 6 2 0
  6233. 6 1 1 0
  6234. 1 7 1 0
  6235. 2 8 1 0
  6236. 3 9 1 0
  6237. 5 10 1 0
  6238. 6 11 1 0
  6239. M END
  6240. $$$$
  6241. RDKit 3D
  6242. 11 11 0 0 0 0 0 0 0 0999 V2000
  6243. -0.2702 0.0202 1.1525 C 0 0 0 0 0 0 0 0 0 0 0 0
  6244. -1.2785 0.0136 0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0
  6245. -0.9129 -0.0103 -1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  6246. 0.3682 -0.0276 -1.5705 N 0 0 0 0 0 0 0 0 0 0 0 0
  6247. 1.3253 -0.0206 -0.6172 C 0 0 0 0 0 0 0 0 0 0 0 0
  6248. 1.0589 0.0028 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  6249. -0.5180 0.0388 2.2098 H 0 0 0 0 0 0 0 0 0 0 0 0
  6250. -2.3238 0.0268 0.4812 H 0 0 0 0 0 0 0 0 0 0 0 0
  6251. -1.6631 -0.0163 -1.9275 H 0 0 0 0 0 0 0 0 0 0 0 0
  6252. 2.3464 -0.0348 -0.9872 H 0 0 0 0 0 0 0 0 0 0 0 0
  6253. 1.8678 0.0074 1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
  6254. 1 2 2 0
  6255. 2 3 1 0
  6256. 3 4 2 0
  6257. 4 5 1 0
  6258. 5 6 2 0
  6259. 6 1 1 0
  6260. 1 7 1 0
  6261. 2 8 1 0
  6262. 3 9 1 0
  6263. 5 10 1 0
  6264. 6 11 1 0
  6265. M END
  6266. $$$$
  6267. RDKit 3D
  6268. 11 11 0 0 0 0 0 0 0 0999 V2000
  6269. -0.2702 0.0130 1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  6270. -1.2785 0.0124 0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
  6271. -0.9129 -0.0031 -1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  6272. 0.3682 -0.0177 -1.5706 N 0 0 0 0 0 0 0 0 0 0 0 0
  6273. 1.3253 -0.0167 -0.6173 C 0 0 0 0 0 0 0 0 0 0 0 0
  6274. 1.0589 -0.0018 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  6275. -0.5180 0.0249 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  6276. -2.3238 0.0237 0.4813 H 0 0 0 0 0 0 0 0 0 0 0 0
  6277. -1.6631 -0.0042 -1.9275 H 0 0 0 0 0 0 0 0 0 0 0 0
  6278. 2.3464 -0.0286 -0.9874 H 0 0 0 0 0 0 0 0 0 0 0 0
  6279. 1.8678 -0.0018 1.4642 H 0 0 0 0 0 0 0 0 0 0 0 0
  6280. 1 2 2 0
  6281. 2 3 1 0
  6282. 3 4 2 0
  6283. 4 5 1 0
  6284. 5 6 2 0
  6285. 6 1 1 0
  6286. 1 7 1 0
  6287. 2 8 1 0
  6288. 3 9 1 0
  6289. 5 10 1 0
  6290. 6 11 1 0
  6291. M END
  6292. $$$$
  6293. RDKit 3D
  6294. 11 11 0 0 0 0 0 0 0 0999 V2000
  6295. -0.2702 0.0057 1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  6296. -1.2785 0.0112 0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
  6297. -0.9129 0.0041 -1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  6298. 0.3682 -0.0078 -1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
  6299. 1.3253 -0.0129 -0.6174 C 0 0 0 0 0 0 0 0 0 0 0 0
  6300. 1.0589 -0.0065 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  6301. -0.5180 0.0110 2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0
  6302. -2.3238 0.0207 0.4815 H 0 0 0 0 0 0 0 0 0 0 0 0
  6303. -1.6631 0.0079 -1.9275 H 0 0 0 0 0 0 0 0 0 0 0 0
  6304. 2.3464 -0.0224 -0.9875 H 0 0 0 0 0 0 0 0 0 0 0 0
  6305. 1.8678 -0.0110 1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
  6306. 1 2 2 0
  6307. 2 3 1 0
  6308. 3 4 2 0
  6309. 4 5 1 0
  6310. 5 6 2 0
  6311. 6 1 1 0
  6312. 1 7 1 0
  6313. 2 8 1 0
  6314. 3 9 1 0
  6315. 5 10 1 0
  6316. 6 11 1 0
  6317. M END
  6318. $$$$
  6319. RDKit 3D
  6320. 11 11 0 0 0 0 0 0 0 0999 V2000
  6321. -0.2702 -0.0015 1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  6322. -1.2785 0.0100 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
  6323. -0.9129 0.0113 -1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  6324. 0.3682 0.0020 -1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
  6325. 1.3253 -0.0090 -0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  6326. 1.0589 -0.0112 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  6327. -0.5180 -0.0029 2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0
  6328. -2.3238 0.0177 0.4816 H 0 0 0 0 0 0 0 0 0 0 0 0
  6329. -1.6631 0.0200 -1.9274 H 0 0 0 0 0 0 0 0 0 0 0 0
  6330. 2.3464 -0.0162 -0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  6331. 1.8678 -0.0202 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0
  6332. 1 2 2 0
  6333. 2 3 1 0
  6334. 3 4 2 0
  6335. 4 5 1 0
  6336. 5 6 2 0
  6337. 6 1 1 0
  6338. 1 7 1 0
  6339. 2 8 1 0
  6340. 3 9 1 0
  6341. 5 10 1 0
  6342. 6 11 1 0
  6343. M END
  6344. $$$$
  6345. RDKit 3D
  6346. 11 11 0 0 0 0 0 0 0 0999 V2000
  6347. -0.2702 -0.0087 1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  6348. -1.2785 0.0087 0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  6349. -0.9129 0.0184 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0
  6350. 0.3682 0.0119 -1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
  6351. 1.3253 -0.0051 -0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  6352. 1.0589 -0.0158 0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0
  6353. -0.5180 -0.0167 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  6354. -2.3238 0.0147 0.4817 H 0 0 0 0 0 0 0 0 0 0 0 0
  6355. -1.6631 0.0321 -1.9273 H 0 0 0 0 0 0 0 0 0 0 0 0
  6356. 2.3464 -0.0100 -0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  6357. 1.8678 -0.0294 1.4639 H 0 0 0 0 0 0 0 0 0 0 0 0
  6358. 1 2 2 0
  6359. 2 3 1 0
  6360. 3 4 2 0
  6361. 4 5 1 0
  6362. 5 6 2 0
  6363. 6 1 1 0
  6364. 1 7 1 0
  6365. 2 8 1 0
  6366. 3 9 1 0
  6367. 5 10 1 0
  6368. 6 11 1 0
  6369. M END
  6370. $$$$
  6371. RDKit 3D
  6372. 11 11 0 0 0 0 0 0 0 0999 V2000
  6373. -0.2702 -0.0160 1.1525 C 0 0 0 0 0 0 0 0 0 0 0 0
  6374. -1.2785 0.0075 0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  6375. -0.9129 0.0256 -1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  6376. 0.3682 0.0218 -1.5706 N 0 0 0 0 0 0 0 0 0 0 0 0
  6377. 1.3253 -0.0012 -0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0
  6378. 1.0589 -0.0205 0.7423 C 0 0 0 0 0 0 0 0 0 0 0 0
  6379. -0.5180 -0.0306 2.2099 H 0 0 0 0 0 0 0 0 0 0 0 0
  6380. -2.3238 0.0116 0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
  6381. -1.6631 0.0442 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0
  6382. 2.3464 -0.0038 -0.9878 H 0 0 0 0 0 0 0 0 0 0 0 0
  6383. 1.8678 -0.0386 1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  6384. 1 2 2 0
  6385. 2 3 1 0
  6386. 3 4 2 0
  6387. 4 5 1 0
  6388. 5 6 2 0
  6389. 6 1 1 0
  6390. 1 7 1 0
  6391. 2 8 1 0
  6392. 3 9 1 0
  6393. 5 10 1 0
  6394. 6 11 1 0
  6395. M END
  6396. $$$$
  6397. RDKit 3D
  6398. 11 11 0 0 0 0 0 0 0 0999 V2000
  6399. -0.2702 -0.0232 1.1524 C 0 0 0 0 0 0 0 0 0 0 0 0
  6400. -1.2785 0.0063 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6401. -0.9129 0.0328 -1.1417 C 0 0 0 0 0 0 0 0 0 0 0 0
  6402. 0.3682 0.0316 -1.5704 N 0 0 0 0 0 0 0 0 0 0 0 0
  6403. 1.3253 0.0027 -0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0
  6404. 1.0589 -0.0252 0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0
  6405. -0.5180 -0.0445 2.2097 H 0 0 0 0 0 0 0 0 0 0 0 0
  6406. -2.3238 0.0086 0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
  6407. -1.6631 0.0563 -1.9267 H 0 0 0 0 0 0 0 0 0 0 0 0
  6408. 2.3464 0.0024 -0.9878 H 0 0 0 0 0 0 0 0 0 0 0 0
  6409. 1.8678 -0.0478 1.4634 H 0 0 0 0 0 0 0 0 0 0 0 0
  6410. 1 2 2 0
  6411. 2 3 1 0
  6412. 3 4 2 0
  6413. 4 5 1 0
  6414. 5 6 2 0
  6415. 6 1 1 0
  6416. 1 7 1 0
  6417. 2 8 1 0
  6418. 3 9 1 0
  6419. 5 10 1 0
  6420. 6 11 1 0
  6421. M END
  6422. $$$$
  6423. RDKit 3D
  6424. 11 11 0 0 0 0 0 0 0 0999 V2000
  6425. -0.2702 -0.0305 1.1522 C 0 0 0 0 0 0 0 0 0 0 0 0
  6426. -1.2785 0.0051 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6427. -0.9129 0.0400 -1.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
  6428. 0.3682 0.0415 -1.5702 N 0 0 0 0 0 0 0 0 0 0 0 0
  6429. 1.3253 0.0065 -0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  6430. 1.0589 -0.0298 0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0
  6431. -0.5180 -0.0584 2.2093 H 0 0 0 0 0 0 0 0 0 0 0 0
  6432. -2.3238 0.0056 0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  6433. -1.6631 0.0684 -1.9263 H 0 0 0 0 0 0 0 0 0 0 0 0
  6434. 2.3464 0.0086 -0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  6435. 1.8678 -0.0570 1.4631 H 0 0 0 0 0 0 0 0 0 0 0 0
  6436. 1 2 2 0
  6437. 2 3 1 0
  6438. 3 4 2 0
  6439. 4 5 1 0
  6440. 5 6 2 0
  6441. 6 1 1 0
  6442. 1 7 1 0
  6443. 2 8 1 0
  6444. 3 9 1 0
  6445. 5 10 1 0
  6446. 6 11 1 0
  6447. M END
  6448. $$$$
  6449. RDKit 3D
  6450. 11 11 0 0 0 0 0 0 0 0999 V2000
  6451. -0.2702 -0.0377 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
  6452. -1.2785 0.0038 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6453. -0.9129 0.0471 -1.1412 C 0 0 0 0 0 0 0 0 0 0 0 0
  6454. 0.3682 0.0514 -1.5699 N 0 0 0 0 0 0 0 0 0 0 0 0
  6455. 1.3253 0.0104 -0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  6456. 1.0589 -0.0345 0.7417 C 0 0 0 0 0 0 0 0 0 0 0 0
  6457. -0.5180 -0.0723 2.2089 H 0 0 0 0 0 0 0 0 0 0 0 0
  6458. -2.3238 0.0025 0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  6459. -1.6631 0.0805 -1.9259 H 0 0 0 0 0 0 0 0 0 0 0 0
  6460. 2.3464 0.0148 -0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  6461. 1.8678 -0.0662 1.4627 H 0 0 0 0 0 0 0 0 0 0 0 0
  6462. 1 2 2 0
  6463. 2 3 1 0
  6464. 3 4 2 0
  6465. 4 5 1 0
  6466. 5 6 2 0
  6467. 6 1 1 0
  6468. 1 7 1 0
  6469. 2 8 1 0
  6470. 3 9 1 0
  6471. 5 10 1 0
  6472. 6 11 1 0
  6473. M END
  6474. $$$$
  6475. RDKit 3D
  6476. 11 11 0 0 0 0 0 0 0 0999 V2000
  6477. -0.2702 -0.0449 1.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
  6478. -1.2785 0.0026 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6479. -0.9129 0.0543 -1.1409 C 0 0 0 0 0 0 0 0 0 0 0 0
  6480. 0.3682 0.0612 -1.5695 N 0 0 0 0 0 0 0 0 0 0 0 0
  6481. 1.3253 0.0143 -0.6174 C 0 0 0 0 0 0 0 0 0 0 0 0
  6482. 1.0589 -0.0391 0.7415 C 0 0 0 0 0 0 0 0 0 0 0 0
  6483. -0.5180 -0.0862 2.2084 H 0 0 0 0 0 0 0 0 0 0 0 0
  6484. -2.3238 -0.0005 0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  6485. -1.6631 0.0926 -1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0
  6486. 2.3464 0.0210 -0.9876 H 0 0 0 0 0 0 0 0 0 0 0 0
  6487. 1.8678 -0.0754 1.4622 H 0 0 0 0 0 0 0 0 0 0 0 0
  6488. 1 2 2 0
  6489. 2 3 1 0
  6490. 3 4 2 0
  6491. 4 5 1 0
  6492. 5 6 2 0
  6493. 6 1 1 0
  6494. 1 7 1 0
  6495. 2 8 1 0
  6496. 3 9 1 0
  6497. 5 10 1 0
  6498. 6 11 1 0
  6499. M END
  6500. $$$$
  6501. RDKit 3D
  6502. 11 11 0 0 0 0 0 0 0 0999 V2000
  6503. -0.2702 -0.0522 1.1515 C 0 0 0 0 0 0 0 0 0 0 0 0
  6504. -1.2785 0.0014 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6505. -0.9129 0.0615 -1.1405 C 0 0 0 0 0 0 0 0 0 0 0 0
  6506. 0.3682 0.0711 -1.5691 N 0 0 0 0 0 0 0 0 0 0 0 0
  6507. 1.3253 0.0182 -0.6173 C 0 0 0 0 0 0 0 0 0 0 0 0
  6508. 1.0589 -0.0438 0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0
  6509. -0.5180 -0.1000 2.2078 H 0 0 0 0 0 0 0 0 0 0 0 0
  6510. -2.3238 -0.0035 0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  6511. -1.6631 0.1047 -1.9247 H 0 0 0 0 0 0 0 0 0 0 0 0
  6512. 2.3464 0.0272 -0.9874 H 0 0 0 0 0 0 0 0 0 0 0 0
  6513. 1.8678 -0.0846 1.4617 H 0 0 0 0 0 0 0 0 0 0 0 0
  6514. 1 2 2 0
  6515. 2 3 1 0
  6516. 3 4 2 0
  6517. 4 5 1 0
  6518. 5 6 2 0
  6519. 6 1 1 0
  6520. 1 7 1 0
  6521. 2 8 1 0
  6522. 3 9 1 0
  6523. 5 10 1 0
  6524. 6 11 1 0
  6525. M END
  6526. $$$$
  6527. RDKit 3D
  6528. 11 11 0 0 0 0 0 0 0 0999 V2000
  6529. -0.2702 -0.0594 1.1511 C 0 0 0 0 0 0 0 0 0 0 0 0
  6530. -1.2785 0.0002 0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0
  6531. -0.9129 0.0686 -1.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
  6532. 0.3682 0.0810 -1.5686 N 0 0 0 0 0 0 0 0 0 0 0 0
  6533. 1.3253 0.0221 -0.6172 C 0 0 0 0 0 0 0 0 0 0 0 0
  6534. 1.0589 -0.0485 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0
  6535. -0.5180 -0.1139 2.2072 H 0 0 0 0 0 0 0 0 0 0 0 0
  6536. -2.3238 -0.0065 0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  6537. -1.6631 0.1168 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0
  6538. 2.3464 0.0334 -0.9872 H 0 0 0 0 0 0 0 0 0 0 0 0
  6539. 1.8678 -0.0937 1.4612 H 0 0 0 0 0 0 0 0 0 0 0 0
  6540. 1 2 2 0
  6541. 2 3 1 0
  6542. 3 4 2 0
  6543. 4 5 1 0
  6544. 5 6 2 0
  6545. 6 1 1 0
  6546. 1 7 1 0
  6547. 2 8 1 0
  6548. 3 9 1 0
  6549. 5 10 1 0
  6550. 6 11 1 0
  6551. M END
  6552. $$$$
  6553. RDKit 3D
  6554. 11 11 0 0 0 0 0 0 0 0999 V2000
  6555. -0.2702 -0.0666 1.1507 C 0 0 0 0 0 0 0 0 0 0 0 0
  6556. -1.2785 -0.0011 0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0
  6557. -0.9129 0.0758 -1.1396 C 0 0 0 0 0 0 0 0 0 0 0 0
  6558. 0.3682 0.0908 -1.5681 N 0 0 0 0 0 0 0 0 0 0 0 0
  6559. 1.3253 0.0259 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0
  6560. 1.0589 -0.0531 0.7406 C 0 0 0 0 0 0 0 0 0 0 0 0
  6561. -0.5180 -0.1278 2.2064 H 0 0 0 0 0 0 0 0 0 0 0 0
  6562. -2.3238 -0.0096 0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
  6563. -1.6631 0.1289 -1.9232 H 0 0 0 0 0 0 0 0 0 0 0 0
  6564. 2.3464 0.0396 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0
  6565. 1.8678 -0.1029 1.4605 H 0 0 0 0 0 0 0 0 0 0 0 0
  6566. 1 2 2 0
  6567. 2 3 1 0
  6568. 3 4 2 0
  6569. 4 5 1 0
  6570. 5 6 2 0
  6571. 6 1 1 0
  6572. 1 7 1 0
  6573. 2 8 1 0
  6574. 3 9 1 0
  6575. 5 10 1 0
  6576. 6 11 1 0
  6577. M END
  6578. $$$$
  6579. RDKit 3D
  6580. 11 11 0 0 0 0 0 0 0 0999 V2000
  6581. -0.2702 -0.0739 1.1503 C 0 0 0 0 0 0 0 0 0 0 0 0
  6582. -1.2785 -0.0023 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6583. -0.9129 0.0829 -1.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
  6584. 0.3682 0.1007 -1.5675 N 0 0 0 0 0 0 0 0 0 0 0 0
  6585. 1.3253 0.0298 -0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0
  6586. 1.0589 -0.0578 0.7403 C 0 0 0 0 0 0 0 0 0 0 0 0
  6587. -0.5180 -0.1416 2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0
  6588. -2.3238 -0.0126 0.4817 H 0 0 0 0 0 0 0 0 0 0 0 0
  6589. -1.6631 0.1410 -1.9224 H 0 0 0 0 0 0 0 0 0 0 0 0
  6590. 2.3464 0.0458 -0.9867 H 0 0 0 0 0 0 0 0 0 0 0 0
  6591. 1.8678 -0.1121 1.4599 H 0 0 0 0 0 0 0 0 0 0 0 0
  6592. 1 2 2 0
  6593. 2 3 1 0
  6594. 3 4 2 0
  6595. 4 5 1 0
  6596. 5 6 2 0
  6597. 6 1 1 0
  6598. 1 7 1 0
  6599. 2 8 1 0
  6600. 3 9 1 0
  6601. 5 10 1 0
  6602. 6 11 1 0
  6603. M END
  6604. $$$$
  6605. RDKit 3D
  6606. 11 11 0 0 0 0 0 0 0 0999 V2000
  6607. -0.2702 -0.0811 1.1498 C 0 0 0 0 0 0 0 0 0 0 0 0
  6608. -1.2785 -0.0035 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6609. -0.9129 0.0901 -1.1386 C 0 0 0 0 0 0 0 0 0 0 0 0
  6610. 0.3682 0.1105 -1.5668 N 0 0 0 0 0 0 0 0 0 0 0 0
  6611. 1.3253 0.0337 -0.6166 C 0 0 0 0 0 0 0 0 0 0 0 0
  6612. 1.0589 -0.0624 0.7399 C 0 0 0 0 0 0 0 0 0 0 0 0
  6613. -0.5180 -0.1555 2.2046 H 0 0 0 0 0 0 0 0 0 0 0 0
  6614. -2.3238 -0.0156 0.4816 H 0 0 0 0 0 0 0 0 0 0 0 0
  6615. -1.6631 0.1531 -1.9214 H 0 0 0 0 0 0 0 0 0 0 0 0
  6616. 2.3464 0.0520 -0.9864 H 0 0 0 0 0 0 0 0 0 0 0 0
  6617. 1.8678 -0.1213 1.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
  6618. 1 2 2 0
  6619. 2 3 1 0
  6620. 3 4 2 0
  6621. 4 5 1 0
  6622. 5 6 2 0
  6623. 6 1 1 0
  6624. 1 7 1 0
  6625. 2 8 1 0
  6626. 3 9 1 0
  6627. 5 10 1 0
  6628. 6 11 1 0
  6629. M END
  6630. $$$$
  6631. RDKit 3D
  6632. 11 11 0 0 0 0 0 0 0 0999 V2000
  6633. -0.2702 -0.0883 1.1493 C 0 0 0 0 0 0 0 0 0 0 0 0
  6634. -1.2785 -0.0047 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6635. -0.9129 0.0973 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0
  6636. 0.3682 0.1203 -1.5661 N 0 0 0 0 0 0 0 0 0 0 0 0
  6637. 1.3253 0.0376 -0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0
  6638. 1.0589 -0.0671 0.7395 C 0 0 0 0 0 0 0 0 0 0 0 0
  6639. -0.5180 -0.1693 2.2036 H 0 0 0 0 0 0 0 0 0 0 0 0
  6640. -2.3238 -0.0186 0.4815 H 0 0 0 0 0 0 0 0 0 0 0 0
  6641. -1.6631 0.1651 -1.9205 H 0 0 0 0 0 0 0 0 0 0 0 0
  6642. 2.3464 0.0582 -0.9861 H 0 0 0 0 0 0 0 0 0 0 0 0
  6643. 1.8678 -0.1304 1.4583 H 0 0 0 0 0 0 0 0 0 0 0 0
  6644. 1 2 2 0
  6645. 2 3 1 0
  6646. 3 4 2 0
  6647. 4 5 1 0
  6648. 5 6 2 0
  6649. 6 1 1 0
  6650. 1 7 1 0
  6651. 2 8 1 0
  6652. 3 9 1 0
  6653. 5 10 1 0
  6654. 6 11 1 0
  6655. M END
  6656. $$$$
  6657. RDKit 3D
  6658. 11 11 0 0 0 0 0 0 0 0999 V2000
  6659. -0.2702 -0.0955 1.1487 C 0 0 0 0 0 0 0 0 0 0 0 0
  6660. -1.2785 -0.0060 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  6661. -0.9129 0.1044 -1.1374 C 0 0 0 0 0 0 0 0 0 0 0 0
  6662. 0.3682 0.1302 -1.5653 N 0 0 0 0 0 0 0 0 0 0 0 0
  6663. 1.3253 0.0414 -0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0
  6664. 1.0589 -0.0717 0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0
  6665. -0.5180 -0.1832 2.2025 H 0 0 0 0 0 0 0 0 0 0 0 0
  6666. -2.3238 -0.0217 0.4814 H 0 0 0 0 0 0 0 0 0 0 0 0
  6667. -1.6631 0.1772 -1.9194 H 0 0 0 0 0 0 0 0 0 0 0 0
  6668. 2.3464 0.0644 -0.9857 H 0 0 0 0 0 0 0 0 0 0 0 0
  6669. 1.8678 -0.1396 1.4575 H 0 0 0 0 0 0 0 0 0 0 0 0
  6670. 1 2 2 0
  6671. 2 3 1 0
  6672. 3 4 2 0
  6673. 4 5 1 0
  6674. 5 6 2 0
  6675. 6 1 1 0
  6676. 1 7 1 0
  6677. 2 8 1 0
  6678. 3 9 1 0
  6679. 5 10 1 0
  6680. 6 11 1 0
  6681. M END
  6682. $$$$
  6683. RDKit 3D
  6684. 11 11 0 0 0 0 0 0 0 0999 V2000
  6685. -0.2702 -0.1027 1.1481 C 0 0 0 0 0 0 0 0 0 0 0 0
  6686. -1.2785 -0.0072 0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  6687. -0.9129 0.1115 -1.1367 C 0 0 0 0 0 0 0 0 0 0 0 0
  6688. 0.3682 0.1400 -1.5645 N 0 0 0 0 0 0 0 0 0 0 0 0
  6689. 1.3253 0.0453 -0.6159 C 0 0 0 0 0 0 0 0 0 0 0 0
  6690. 1.0589 -0.0764 0.7386 C 0 0 0 0 0 0 0 0 0 0 0 0
  6691. -0.5180 -0.1970 2.2013 H 0 0 0 0 0 0 0 0 0 0 0 0
  6692. -2.3238 -0.0247 0.4813 H 0 0 0 0 0 0 0 0 0 0 0 0
  6693. -1.6631 0.1893 -1.9182 H 0 0 0 0 0 0 0 0 0 0 0 0
  6694. 2.3464 0.0706 -0.9853 H 0 0 0 0 0 0 0 0 0 0 0 0
  6695. 1.8678 -0.1487 1.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
  6696. 1 2 2 0
  6697. 2 3 1 0
  6698. 3 4 2 0
  6699. 4 5 1 0
  6700. 5 6 2 0
  6701. 6 1 1 0
  6702. 1 7 1 0
  6703. 2 8 1 0
  6704. 3 9 1 0
  6705. 5 10 1 0
  6706. 6 11 1 0
  6707. M END
  6708. $$$$
  6709. RDKit 3D
  6710. 11 11 0 0 0 0 0 0 0 0999 V2000
  6711. -0.2702 -0.1100 1.1474 C 0 0 0 0 0 0 0 0 0 0 0 0
  6712. -1.2785 -0.0084 0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  6713. -0.9129 0.1187 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0
  6714. 0.3682 0.1498 -1.5636 N 0 0 0 0 0 0 0 0 0 0 0 0
  6715. 1.3253 0.0492 -0.6156 C 0 0 0 0 0 0 0 0 0 0 0 0
  6716. 1.0589 -0.0810 0.7381 C 0 0 0 0 0 0 0 0 0 0 0 0
  6717. -0.5180 -0.2108 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6718. -2.3238 -0.0277 0.4811 H 0 0 0 0 0 0 0 0 0 0 0 0
  6719. -1.6631 0.2013 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
  6720. 2.3464 0.0768 -0.9848 H 0 0 0 0 0 0 0 0 0 0 0 0
  6721. 1.8678 -0.1579 1.4556 H 0 0 0 0 0 0 0 0 0 0 0 0
  6722. 1 2 2 0
  6723. 2 3 1 0
  6724. 3 4 2 0
  6725. 4 5 1 0
  6726. 5 6 2 0
  6727. 6 1 1 0
  6728. 1 7 1 0
  6729. 2 8 1 0
  6730. 3 9 1 0
  6731. 5 10 1 0
  6732. 6 11 1 0
  6733. M END
  6734. $$$$
  6735. RDKit 3D
  6736. 11 11 0 0 0 0 0 0 0 0999 V2000
  6737. -0.2702 -0.1172 1.1467 C 0 0 0 0 0 0 0 0 0 0 0 0
  6738. -1.2785 -0.0096 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
  6739. -0.9129 0.1258 -1.1352 C 0 0 0 0 0 0 0 0 0 0 0 0
  6740. 0.3682 0.1597 -1.5626 N 0 0 0 0 0 0 0 0 0 0 0 0
  6741. 1.3253 0.0530 -0.6153 C 0 0 0 0 0 0 0 0 0 0 0 0
  6742. 1.0589 -0.0856 0.7376 C 0 0 0 0 0 0 0 0 0 0 0 0
  6743. -0.5180 -0.2247 2.1987 H 0 0 0 0 0 0 0 0 0 0 0 0
  6744. -2.3238 -0.0307 0.4809 H 0 0 0 0 0 0 0 0 0 0 0 0
  6745. -1.6631 0.2134 -1.9157 H 0 0 0 0 0 0 0 0 0 0 0 0
  6746. 2.3464 0.0830 -0.9843 H 0 0 0 0 0 0 0 0 0 0 0 0
  6747. 1.8678 -0.1670 1.4546 H 0 0 0 0 0 0 0 0 0 0 0 0
  6748. 1 2 2 0
  6749. 2 3 1 0
  6750. 3 4 2 0
  6751. 4 5 1 0
  6752. 5 6 2 0
  6753. 6 1 1 0
  6754. 1 7 1 0
  6755. 2 8 1 0
  6756. 3 9 1 0
  6757. 5 10 1 0
  6758. 6 11 1 0
  6759. M END
  6760. $$$$
  6761. RDKit 3D
  6762. 11 11 0 0 0 0 0 0 0 0999 V2000
  6763. -0.2702 -0.1244 1.1459 C 0 0 0 0 0 0 0 0 0 0 0 0
  6764. -1.2785 -0.0108 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
  6765. -0.9129 0.1330 -1.1344 C 0 0 0 0 0 0 0 0 0 0 0 0
  6766. 0.3682 0.1695 -1.5616 N 0 0 0 0 0 0 0 0 0 0 0 0
  6767. 1.3253 0.0569 -0.6149 C 0 0 0 0 0 0 0 0 0 0 0 0
  6768. 1.0589 -0.0903 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0
  6769. -0.5180 -0.2385 2.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
  6770. -2.3238 -0.0338 0.4807 H 0 0 0 0 0 0 0 0 0 0 0 0
  6771. -1.6631 0.2254 -1.9143 H 0 0 0 0 0 0 0 0 0 0 0 0
  6772. 2.3464 0.0892 -0.9838 H 0 0 0 0 0 0 0 0 0 0 0 0
  6773. 1.8678 -0.1762 1.4535 H 0 0 0 0 0 0 0 0 0 0 0 0
  6774. 1 2 2 0
  6775. 2 3 1 0
  6776. 3 4 2 0
  6777. 4 5 1 0
  6778. 5 6 2 0
  6779. 6 1 1 0
  6780. 1 7 1 0
  6781. 2 8 1 0
  6782. 3 9 1 0
  6783. 5 10 1 0
  6784. 6 11 1 0
  6785. M END
  6786. $$$$
  6787. RDKit 3D
  6788. 11 11 0 0 0 0 0 0 0 0999 V2000
  6789. -0.2702 -0.1316 1.1451 C 0 0 0 0 0 0 0 0 0 0 0 0
  6790. -1.2785 -0.0121 0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
  6791. -0.9129 0.1401 -1.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
  6792. 0.3682 0.1793 -1.5605 N 0 0 0 0 0 0 0 0 0 0 0 0
  6793. 1.3253 0.0608 -0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0
  6794. 1.0589 -0.0949 0.7365 C 0 0 0 0 0 0 0 0 0 0 0 0
  6795. -0.5180 -0.2523 2.1957 H 0 0 0 0 0 0 0 0 0 0 0 0
  6796. -2.3238 -0.0368 0.4805 H 0 0 0 0 0 0 0 0 0 0 0 0
  6797. -1.6631 0.2374 -1.9129 H 0 0 0 0 0 0 0 0 0 0 0 0
  6798. 2.3464 0.0953 -0.9832 H 0 0 0 0 0 0 0 0 0 0 0 0
  6799. 1.8678 -0.1853 1.4524 H 0 0 0 0 0 0 0 0 0 0 0 0
  6800. 1 2 2 0
  6801. 2 3 1 0
  6802. 3 4 2 0
  6803. 4 5 1 0
  6804. 5 6 2 0
  6805. 6 1 1 0
  6806. 1 7 1 0
  6807. 2 8 1 0
  6808. 3 9 1 0
  6809. 5 10 1 0
  6810. 6 11 1 0
  6811. M END
  6812. $$$$
  6813. RDKit 3D
  6814. 11 11 0 0 0 0 0 0 0 0999 V2000
  6815. -0.2702 -0.1388 1.1443 C 0 0 0 0 0 0 0 0 0 0 0 0
  6816. -1.2785 -0.0133 0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0
  6817. -0.9129 0.1472 -1.1326 C 0 0 0 0 0 0 0 0 0 0 0 0
  6818. 0.3682 0.1891 -1.5593 N 0 0 0 0 0 0 0 0 0 0 0 0
  6819. 1.3253 0.0646 -0.6142 C 0 0 0 0 0 0 0 0 0 0 0 0
  6820. 1.0589 -0.0995 0.7358 C 0 0 0 0 0 0 0 0 0 0 0 0
  6821. -0.5180 -0.2661 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
  6822. -2.3238 -0.0398 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
  6823. -1.6631 0.2494 -1.9113 H 0 0 0 0 0 0 0 0 0 0 0 0
  6824. 2.3464 0.1015 -0.9826 H 0 0 0 0 0 0 0 0 0 0 0 0
  6825. 1.8678 -0.1944 1.4512 H 0 0 0 0 0 0 0 0 0 0 0 0
  6826. 1 2 2 0
  6827. 2 3 1 0
  6828. 3 4 2 0
  6829. 4 5 1 0
  6830. 5 6 2 0
  6831. 6 1 1 0
  6832. 1 7 1 0
  6833. 2 8 1 0
  6834. 3 9 1 0
  6835. 5 10 1 0
  6836. 6 11 1 0
  6837. M END
  6838. $$$$
  6839. RDKit 3D
  6840. 11 11 0 0 0 0 0 0 0 0999 V2000
  6841. -0.2702 -0.1459 1.1434 C 0 0 0 0 0 0 0 0 0 0 0 0
  6842. -1.2785 -0.0145 0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0
  6843. -0.9129 0.1543 -1.1317 C 0 0 0 0 0 0 0 0 0 0 0 0
  6844. 0.3682 0.1989 -1.5581 N 0 0 0 0 0 0 0 0 0 0 0 0
  6845. 1.3253 0.0685 -0.6138 C 0 0 0 0 0 0 0 0 0 0 0 0
  6846. 1.0589 -0.1041 0.7352 C 0 0 0 0 0 0 0 0 0 0 0 0
  6847. -0.5180 -0.2798 2.1923 H 0 0 0 0 0 0 0 0 0 0 0 0
  6848. -2.3238 -0.0428 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0
  6849. -1.6631 0.2614 -1.9097 H 0 0 0 0 0 0 0 0 0 0 0 0
  6850. 2.3464 0.1077 -0.9819 H 0 0 0 0 0 0 0 0 0 0 0 0
  6851. 1.8678 -0.2035 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0
  6852. 1 2 2 0
  6853. 2 3 1 0
  6854. 3 4 2 0
  6855. 4 5 1 0
  6856. 5 6 2 0
  6857. 6 1 1 0
  6858. 1 7 1 0
  6859. 2 8 1 0
  6860. 3 9 1 0
  6861. 5 10 1 0
  6862. 6 11 1 0
  6863. M END
  6864. $$$$
  6865. RDKit 3D
  6866. 11 11 0 0 0 0 0 0 0 0999 V2000
  6867. -0.2702 -0.1531 1.1424 C 0 0 0 0 0 0 0 0 0 0 0 0
  6868. -1.2785 -0.0157 0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0
  6869. -0.9129 0.1614 -1.1307 C 0 0 0 0 0 0 0 0 0 0 0 0
  6870. 0.3682 0.2087 -1.5568 N 0 0 0 0 0 0 0 0 0 0 0 0
  6871. 1.3253 0.0723 -0.6133 C 0 0 0 0 0 0 0 0 0 0 0 0
  6872. 1.0589 -0.1088 0.7345 C 0 0 0 0 0 0 0 0 0 0 0 0
  6873. -0.5180 -0.2936 2.1905 H 0 0 0 0 0 0 0 0 0 0 0 0
  6874. -2.3238 -0.0458 0.4797 H 0 0 0 0 0 0 0 0 0 0 0 0
  6875. -1.6631 0.2734 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0
  6876. 2.3464 0.1138 -0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0
  6877. 1.8678 -0.2126 1.4486 H 0 0 0 0 0 0 0 0 0 0 0 0
  6878. 1 2 2 0
  6879. 2 3 1 0
  6880. 3 4 2 0
  6881. 4 5 1 0
  6882. 5 6 2 0
  6883. 6 1 1 0
  6884. 1 7 1 0
  6885. 2 8 1 0
  6886. 3 9 1 0
  6887. 5 10 1 0
  6888. 6 11 1 0
  6889. M END
  6890. $$$$
  6891. RDKit 3D
  6892. 11 11 0 0 0 0 0 0 0 0999 V2000
  6893. -0.2702 -0.1603 1.1414 C 0 0 0 0 0 0 0 0 0 0 0 0
  6894. -1.2785 -0.0170 0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
  6895. -0.9129 0.1685 -1.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  6896. 0.3682 0.2184 -1.5555 N 0 0 0 0 0 0 0 0 0 0 0 0
  6897. 1.3253 0.0762 -0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0
  6898. 1.0589 -0.1134 0.7338 C 0 0 0 0 0 0 0 0 0 0 0 0
  6899. -0.5180 -0.3074 2.1886 H 0 0 0 0 0 0 0 0 0 0 0 0
  6900. -2.3238 -0.0488 0.4794 H 0 0 0 0 0 0 0 0 0 0 0 0
  6901. -1.6631 0.2854 -1.9063 H 0 0 0 0 0 0 0 0 0 0 0 0
  6902. 2.3464 0.1200 -0.9805 H 0 0 0 0 0 0 0 0 0 0 0 0
  6903. 1.8678 -0.2217 1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0
  6904. 1 2 2 0
  6905. 2 3 1 0
  6906. 3 4 2 0
  6907. 4 5 1 0
  6908. 5 6 2 0
  6909. 6 1 1 0
  6910. 1 7 1 0
  6911. 2 8 1 0
  6912. 3 9 1 0
  6913. 5 10 1 0
  6914. 6 11 1 0
  6915. M END
  6916. $$$$
  6917. RDKit 3D
  6918. 11 11 0 0 0 0 0 0 0 0999 V2000
  6919. -0.2702 -0.1675 1.1404 C 0 0 0 0 0 0 0 0 0 0 0 0
  6920. -1.2785 -0.0182 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0
  6921. -0.9129 0.1756 -1.1286 C 0 0 0 0 0 0 0 0 0 0 0 0
  6922. 0.3682 0.2282 -1.5541 N 0 0 0 0 0 0 0 0 0 0 0 0
  6923. 1.3253 0.0800 -0.6124 C 0 0 0 0 0 0 0 0 0 0 0 0
  6924. 1.0589 -0.1180 0.7331 C 0 0 0 0 0 0 0 0 0 0 0 0
  6925. -0.5180 -0.3211 2.1867 H 0 0 0 0 0 0 0 0 0 0 0 0
  6926. -2.3238 -0.0519 0.4791 H 0 0 0 0 0 0 0 0 0 0 0 0
  6927. -1.6631 0.2974 -1.9045 H 0 0 0 0 0 0 0 0 0 0 0 0
  6928. 2.3464 0.1262 -0.9797 H 0 0 0 0 0 0 0 0 0 0 0 0
  6929. 1.8678 -0.2308 1.4459 H 0 0 0 0 0 0 0 0 0 0 0 0
  6930. 1 2 2 0
  6931. 2 3 1 0
  6932. 3 4 2 0
  6933. 4 5 1 0
  6934. 5 6 2 0
  6935. 6 1 1 0
  6936. 1 7 1 0
  6937. 2 8 1 0
  6938. 3 9 1 0
  6939. 5 10 1 0
  6940. 6 11 1 0
  6941. M END
  6942. $$$$
  6943. RDKit 3D
  6944. 11 11 0 0 0 0 0 0 0 0999 V2000
  6945. -0.2702 -0.1746 1.1393 C 0 0 0 0 0 0 0 0 0 0 0 0
  6946. -1.2785 -0.0194 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0
  6947. -0.9129 0.1827 -1.1274 C 0 0 0 0 0 0 0 0 0 0 0 0
  6948. 0.3682 0.2380 -1.5526 N 0 0 0 0 0 0 0 0 0 0 0 0
  6949. 1.3253 0.0839 -0.6118 C 0 0 0 0 0 0 0 0 0 0 0 0
  6950. 1.0589 -0.1226 0.7324 C 0 0 0 0 0 0 0 0 0 0 0 0
  6951. -0.5180 -0.3348 2.1846 H 0 0 0 0 0 0 0 0 0 0 0 0
  6952. -2.3238 -0.0549 0.4788 H 0 0 0 0 0 0 0 0 0 0 0 0
  6953. -1.6631 0.3093 -1.9026 H 0 0 0 0 0 0 0 0 0 0 0 0
  6954. 2.3464 0.1323 -0.9789 H 0 0 0 0 0 0 0 0 0 0 0 0
  6955. 1.8678 -0.2399 1.4444 H 0 0 0 0 0 0 0 0 0 0 0 0
  6956. 1 2 2 0
  6957. 2 3 1 0
  6958. 3 4 2 0
  6959. 4 5 1 0
  6960. 5 6 2 0
  6961. 6 1 1 0
  6962. 1 7 1 0
  6963. 2 8 1 0
  6964. 3 9 1 0
  6965. 5 10 1 0
  6966. 6 11 1 0
  6967. M END
  6968. $$$$
  6969. RDKit 3D
  6970. 11 11 0 0 0 0 0 0 0 0999 V2000
  6971. -0.2702 -0.1818 1.1382 C 0 0 0 0 0 0 0 0 0 0 0 0
  6972. -1.2785 -0.0206 0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0
  6973. -0.9129 0.1898 -1.1263 C 0 0 0 0 0 0 0 0 0 0 0 0
  6974. 0.3682 0.2477 -1.5511 N 0 0 0 0 0 0 0 0 0 0 0 0
  6975. 1.3253 0.0877 -0.6113 C 0 0 0 0 0 0 0 0 0 0 0 0
  6976. 1.0589 -0.1272 0.7316 C 0 0 0 0 0 0 0 0 0 0 0 0
  6977. -0.5180 -0.3486 2.1824 H 0 0 0 0 0 0 0 0 0 0 0 0
  6978. -2.3238 -0.0579 0.4784 H 0 0 0 0 0 0 0 0 0 0 0 0
  6979. -1.6631 0.3213 -1.9006 H 0 0 0 0 0 0 0 0 0 0 0 0
  6980. 2.3464 0.1385 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
  6981. 1.8678 -0.2490 1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0
  6982. 1 2 2 0
  6983. 2 3 1 0
  6984. 3 4 2 0
  6985. 4 5 1 0
  6986. 5 6 2 0
  6987. 6 1 1 0
  6988. 1 7 1 0
  6989. 2 8 1 0
  6990. 3 9 1 0
  6991. 5 10 1 0
  6992. 6 11 1 0
  6993. M END
  6994. $$$$
  6995. RDKit 3D
  6996. 11 11 0 0 0 0 0 0 0 0999 V2000
  6997. -0.2702 -0.1889 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  6998. -1.2785 -0.0218 0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0
  6999. -0.9129 0.1969 -1.1251 C 0 0 0 0 0 0 0 0 0 0 0 0
  7000. 0.3682 0.2575 -1.5495 N 0 0 0 0 0 0 0 0 0 0 0 0
  7001. 1.3253 0.0916 -0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0
  7002. 1.0589 -0.1318 0.7308 C 0 0 0 0 0 0 0 0 0 0 0 0
  7003. -0.5180 -0.3623 2.1802 H 0 0 0 0 0 0 0 0 0 0 0 0
  7004. -2.3238 -0.0609 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
  7005. -1.6631 0.3332 -1.8985 H 0 0 0 0 0 0 0 0 0 0 0 0
  7006. 2.3464 0.1446 -0.9771 H 0 0 0 0 0 0 0 0 0 0 0 0
  7007. 1.8678 -0.2580 1.4412 H 0 0 0 0 0 0 0 0 0 0 0 0
  7008. 1 2 2 0
  7009. 2 3 1 0
  7010. 3 4 2 0
  7011. 4 5 1 0
  7012. 5 6 2 0
  7013. 6 1 1 0
  7014. 1 7 1 0
  7015. 2 8 1 0
  7016. 3 9 1 0
  7017. 5 10 1 0
  7018. 6 11 1 0
  7019. M END
  7020. $$$$
  7021. RDKit 3D
  7022. 11 11 0 0 0 0 0 0 0 0999 V2000
  7023. -0.2702 -0.1961 1.1358 C 0 0 0 0 0 0 0 0 0 0 0 0
  7024. -1.2785 -0.0230 0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0
  7025. -0.9129 0.2039 -1.1238 C 0 0 0 0 0 0 0 0 0 0 0 0
  7026. 0.3682 0.2672 -1.5478 N 0 0 0 0 0 0 0 0 0 0 0 0
  7027. 1.3253 0.0954 -0.6101 C 0 0 0 0 0 0 0 0 0 0 0 0
  7028. 1.0589 -0.1364 0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0
  7029. -0.5180 -0.3760 2.1779 H 0 0 0 0 0 0 0 0 0 0 0 0
  7030. -2.3238 -0.0639 0.4776 H 0 0 0 0 0 0 0 0 0 0 0 0
  7031. -1.6631 0.3451 -1.8964 H 0 0 0 0 0 0 0 0 0 0 0 0
  7032. 2.3464 0.1507 -0.9762 H 0 0 0 0 0 0 0 0 0 0 0 0
  7033. 1.8678 -0.2671 1.4396 H 0 0 0 0 0 0 0 0 0 0 0 0
  7034. 1 2 2 0
  7035. 2 3 1 0
  7036. 3 4 2 0
  7037. 4 5 1 0
  7038. 5 6 2 0
  7039. 6 1 1 0
  7040. 1 7 1 0
  7041. 2 8 1 0
  7042. 3 9 1 0
  7043. 5 10 1 0
  7044. 6 11 1 0
  7045. M END
  7046. $$$$
  7047. RDKit 3D
  7048. 11 11 0 0 0 0 0 0 0 0999 V2000
  7049. -0.2702 -0.2032 1.1346 C 0 0 0 0 0 0 0 0 0 0 0 0
  7050. -1.2785 -0.0243 0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0
  7051. -0.9129 0.2110 -1.1225 C 0 0 0 0 0 0 0 0 0 0 0 0
  7052. 0.3682 0.2769 -1.5461 N 0 0 0 0 0 0 0 0 0 0 0 0
  7053. 1.3253 0.0992 -0.6095 C 0 0 0 0 0 0 0 0 0 0 0 0
  7054. 1.0589 -0.1409 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0
  7055. -0.5180 -0.3896 2.1755 H 0 0 0 0 0 0 0 0 0 0 0 0
  7056. -2.3238 -0.0669 0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0
  7057. -1.6631 0.3571 -1.8942 H 0 0 0 0 0 0 0 0 0 0 0 0
  7058. 2.3464 0.1569 -0.9752 H 0 0 0 0 0 0 0 0 0 0 0 0
  7059. 1.8678 -0.2761 1.4379 H 0 0 0 0 0 0 0 0 0 0 0 0
  7060. 1 2 2 0
  7061. 2 3 1 0
  7062. 3 4 2 0
  7063. 4 5 1 0
  7064. 5 6 2 0
  7065. 6 1 1 0
  7066. 1 7 1 0
  7067. 2 8 1 0
  7068. 3 9 1 0
  7069. 5 10 1 0
  7070. 6 11 1 0
  7071. M END
  7072. $$$$
  7073. RDKit 3D
  7074. 11 11 0 0 0 0 0 0 0 0999 V2000
  7075. -0.2702 -0.2103 1.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
  7076. -1.2785 -0.0255 0.1932 C 0 0 0 0 0 0 0 0 0 0 0 0
  7077. -0.9129 0.2180 -1.1212 C 0 0 0 0 0 0 0 0 0 0 0 0
  7078. 0.3682 0.2866 -1.5444 N 0 0 0 0 0 0 0 0 0 0 0 0
  7079. 1.3253 0.1031 -0.6089 C 0 0 0 0 0 0 0 0 0 0 0 0
  7080. 1.0589 -0.1455 0.7281 C 0 0 0 0 0 0 0 0 0 0 0 0
  7081. -0.5180 -0.4033 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  7082. -2.3238 -0.0699 0.4768 H 0 0 0 0 0 0 0 0 0 0 0 0
  7083. -1.6631 0.3689 -1.8919 H 0 0 0 0 0 0 0 0 0 0 0 0
  7084. 2.3464 0.1630 -0.9742 H 0 0 0 0 0 0 0 0 0 0 0 0
  7085. 1.8678 -0.2852 1.4361 H 0 0 0 0 0 0 0 0 0 0 0 0
  7086. 1 2 2 0
  7087. 2 3 1 0
  7088. 3 4 2 0
  7089. 4 5 1 0
  7090. 5 6 2 0
  7091. 6 1 1 0
  7092. 1 7 1 0
  7093. 2 8 1 0
  7094. 3 9 1 0
  7095. 5 10 1 0
  7096. 6 11 1 0
  7097. M END
  7098. $$$$
  7099. RDKit 3D
  7100. 11 11 0 0 0 0 0 0 0 0999 V2000
  7101. -0.2702 -0.2175 1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0
  7102. -1.2785 -0.0267 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0
  7103. -0.9129 0.2251 -1.1198 C 0 0 0 0 0 0 0 0 0 0 0 0
  7104. 0.3682 0.2963 -1.5425 N 0 0 0 0 0 0 0 0 0 0 0 0
  7105. 1.3253 0.1069 -0.6082 C 0 0 0 0 0 0 0 0 0 0 0 0
  7106. 1.0589 -0.1501 0.7272 C 0 0 0 0 0 0 0 0 0 0 0 0
  7107. -0.5180 -0.4169 2.1704 H 0 0 0 0 0 0 0 0 0 0 0 0
  7108. -2.3238 -0.0729 0.4764 H 0 0 0 0 0 0 0 0 0 0 0 0
  7109. -1.6631 0.3808 -1.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
  7110. 2.3464 0.1691 -0.9732 H 0 0 0 0 0 0 0 0 0 0 0 0
  7111. 1.8678 -0.2942 1.4343 H 0 0 0 0 0 0 0 0 0 0 0 0
  7112. 1 2 2 0
  7113. 2 3 1 0
  7114. 3 4 2 0
  7115. 4 5 1 0
  7116. 5 6 2 0
  7117. 6 1 1 0
  7118. 1 7 1 0
  7119. 2 8 1 0
  7120. 3 9 1 0
  7121. 5 10 1 0
  7122. 6 11 1 0
  7123. M END
  7124. $$$$
  7125. RDKit 3D
  7126. 11 11 0 0 0 0 0 0 0 0999 V2000
  7127. -0.2702 -0.2246 1.1306 C 0 0 0 0 0 0 0 0 0 0 0 0
  7128. -1.2785 -0.0279 0.1928 C 0 0 0 0 0 0 0 0 0 0 0 0
  7129. -0.9129 0.2321 -1.1183 C 0 0 0 0 0 0 0 0 0 0 0 0
  7130. 0.3682 0.3060 -1.5406 N 0 0 0 0 0 0 0 0 0 0 0 0
  7131. 1.3253 0.1107 -0.6076 C 0 0 0 0 0 0 0 0 0 0 0 0
  7132. 1.0589 -0.1547 0.7263 C 0 0 0 0 0 0 0 0 0 0 0 0
  7133. -0.5180 -0.4306 2.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
  7134. -2.3238 -0.0759 0.4759 H 0 0 0 0 0 0 0 0 0 0 0 0
  7135. -1.6631 0.3927 -1.8871 H 0 0 0 0 0 0 0 0 0 0 0 0
  7136. 2.3464 0.1752 -0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0
  7137. 1.8678 -0.3032 1.4324 H 0 0 0 0 0 0 0 0 0 0 0 0
  7138. 1 2 2 0
  7139. 2 3 1 0
  7140. 3 4 2 0
  7141. 4 5 1 0
  7142. 5 6 2 0
  7143. 6 1 1 0
  7144. 1 7 1 0
  7145. 2 8 1 0
  7146. 3 9 1 0
  7147. 5 10 1 0
  7148. 6 11 1 0
  7149. M END
  7150. $$$$
  7151. RDKit 3D
  7152. 11 11 0 0 0 0 0 0 0 0999 V2000
  7153. -0.2702 -0.2317 1.1291 C 0 0 0 0 0 0 0 0 0 0 0 0
  7154. -1.2785 -0.0291 0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0
  7155. -0.9129 0.2391 -1.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
  7156. 0.3682 0.3157 -1.5387 N 0 0 0 0 0 0 0 0 0 0 0 0
  7157. 1.3253 0.1145 -0.6068 C 0 0 0 0 0 0 0 0 0 0 0 0
  7158. 1.0589 -0.1592 0.7253 C 0 0 0 0 0 0 0 0 0 0 0 0
  7159. -0.5180 -0.4442 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  7160. -2.3238 -0.0788 0.4754 H 0 0 0 0 0 0 0 0 0 0 0 0
  7161. -1.6631 0.4045 -1.8846 H 0 0 0 0 0 0 0 0 0 0 0 0
  7162. 2.3464 0.1813 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0
  7163. 1.8678 -0.3122 1.4305 H 0 0 0 0 0 0 0 0 0 0 0 0
  7164. 1 2 2 0
  7165. 2 3 1 0
  7166. 3 4 2 0
  7167. 4 5 1 0
  7168. 5 6 2 0
  7169. 6 1 1 0
  7170. 1 7 1 0
  7171. 2 8 1 0
  7172. 3 9 1 0
  7173. 5 10 1 0
  7174. 6 11 1 0
  7175. M END
  7176. $$$$
  7177. RDKit 3D
  7178. 11 11 0 0 0 0 0 0 0 0999 V2000
  7179. -0.2702 -0.2387 1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
  7180. -1.2785 -0.0303 0.1925 C 0 0 0 0 0 0 0 0 0 0 0 0
  7181. -0.9129 0.2461 -1.1153 C 0 0 0 0 0 0 0 0 0 0 0 0
  7182. 0.3682 0.3253 -1.5367 N 0 0 0 0 0 0 0 0 0 0 0 0
  7183. 1.3253 0.1183 -0.6061 C 0 0 0 0 0 0 0 0 0 0 0 0
  7184. 1.0589 -0.1638 0.7243 C 0 0 0 0 0 0 0 0 0 0 0 0
  7185. -0.5180 -0.4578 2.1622 H 0 0 0 0 0 0 0 0 0 0 0 0
  7186. -2.3238 -0.0818 0.4749 H 0 0 0 0 0 0 0 0 0 0 0 0
  7187. -1.6631 0.4164 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0
  7188. 2.3464 0.1874 -0.9698 H 0 0 0 0 0 0 0 0 0 0 0 0
  7189. 1.8678 -0.3212 1.4285 H 0 0 0 0 0 0 0 0 0 0 0 0
  7190. 1 2 2 0
  7191. 2 3 1 0
  7192. 3 4 2 0
  7193. 4 5 1 0
  7194. 5 6 2 0
  7195. 6 1 1 0
  7196. 1 7 1 0
  7197. 2 8 1 0
  7198. 3 9 1 0
  7199. 5 10 1 0
  7200. 6 11 1 0
  7201. M END
  7202. $$$$
  7203. RDKit 3D
  7204. 11 11 0 0 0 0 0 0 0 0999 V2000
  7205. -0.2702 -0.2458 1.1261 C 0 0 0 0 0 0 0 0 0 0 0 0
  7206. -1.2785 -0.0315 0.1923 C 0 0 0 0 0 0 0 0 0 0 0 0
  7207. -0.9129 0.2531 -1.1137 C 0 0 0 0 0 0 0 0 0 0 0 0
  7208. 0.3682 0.3350 -1.5346 N 0 0 0 0 0 0 0 0 0 0 0 0
  7209. 1.3253 0.1221 -0.6054 C 0 0 0 0 0 0 0 0 0 0 0 0
  7210. 1.0589 -0.1683 0.7232 C 0 0 0 0 0 0 0 0 0 0 0 0
  7211. -0.5180 -0.4714 2.1593 H 0 0 0 0 0 0 0 0 0 0 0 0
  7212. -2.3238 -0.0848 0.4744 H 0 0 0 0 0 0 0 0 0 0 0 0
  7213. -1.6631 0.4282 -1.8794 H 0 0 0 0 0 0 0 0 0 0 0 0
  7214. 2.3464 0.1935 -0.9686 H 0 0 0 0 0 0 0 0 0 0 0 0
  7215. 1.8678 -0.3301 1.4265 H 0 0 0 0 0 0 0 0 0 0 0 0
  7216. 1 2 2 0
  7217. 2 3 1 0
  7218. 3 4 2 0
  7219. 4 5 1 0
  7220. 5 6 2 0
  7221. 6 1 1 0
  7222. 1 7 1 0
  7223. 2 8 1 0
  7224. 3 9 1 0
  7225. 5 10 1 0
  7226. 6 11 1 0
  7227. M END
  7228. $$$$
  7229. RDKit 3D
  7230. 11 11 0 0 0 0 0 0 0 0999 V2000
  7231. -0.2702 -0.2529 1.1246 C 0 0 0 0 0 0 0 0 0 0 0 0
  7232. -1.2785 -0.0327 0.1921 C 0 0 0 0 0 0 0 0 0 0 0 0
  7233. -0.9129 0.2601 -1.1121 C 0 0 0 0 0 0 0 0 0 0 0 0
  7234. 0.3682 0.3446 -1.5325 N 0 0 0 0 0 0 0 0 0 0 0 0
  7235. 1.3253 0.1259 -0.6046 C 0 0 0 0 0 0 0 0 0 0 0 0
  7236. 1.0589 -0.1729 0.7221 C 0 0 0 0 0 0 0 0 0 0 0 0
  7237. -0.5180 -0.4849 2.1563 H 0 0 0 0 0 0 0 0 0 0 0 0
  7238. -2.3238 -0.0878 0.4738 H 0 0 0 0 0 0 0 0 0 0 0 0
  7239. -1.6631 0.4400 -1.8766 H 0 0 0 0 0 0 0 0 0 0 0 0
  7240. 2.3464 0.1996 -0.9674 H 0 0 0 0 0 0 0 0 0 0 0 0
  7241. 1.8678 -0.3391 1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0
  7242. 1 2 2 0
  7243. 2 3 1 0
  7244. 3 4 2 0
  7245. 4 5 1 0
  7246. 5 6 2 0
  7247. 6 1 1 0
  7248. 1 7 1 0
  7249. 2 8 1 0
  7250. 3 9 1 0
  7251. 5 10 1 0
  7252. 6 11 1 0
  7253. M END
  7254. $$$$
  7255. RDKit 3D
  7256. 11 11 0 0 0 0 0 0 0 0999 V2000
  7257. -0.2702 -0.2600 1.1229 C 0 0 0 0 0 0 0 0 0 0 0 0
  7258. -1.2785 -0.0339 0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0
  7259. -0.9129 0.2671 -1.1105 C 0 0 0 0 0 0 0 0 0 0 0 0
  7260. 0.3682 0.3543 -1.5303 N 0 0 0 0 0 0 0 0 0 0 0 0
  7261. 1.3253 0.1297 -0.6038 C 0 0 0 0 0 0 0 0 0 0 0 0
  7262. 1.0589 -0.1774 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0
  7263. -0.5180 -0.4985 2.1532 H 0 0 0 0 0 0 0 0 0 0 0 0
  7264. -2.3238 -0.0908 0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0
  7265. -1.6631 0.4518 -1.8738 H 0 0 0 0 0 0 0 0 0 0 0 0
  7266. 2.3464 0.2057 -0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0
  7267. 1.8678 -0.3480 1.4222 H 0 0 0 0 0 0 0 0 0 0 0 0
  7268. 1 2 2 0
  7269. 2 3 1 0
  7270. 3 4 2 0
  7271. 4 5 1 0
  7272. 5 6 2 0
  7273. 6 1 1 0
  7274. 1 7 1 0
  7275. 2 8 1 0
  7276. 3 9 1 0
  7277. 5 10 1 0
  7278. 6 11 1 0
  7279. M END
  7280. $$$$
  7281. RDKit 3D
  7282. 11 11 0 0 0 0 0 0 0 0999 V2000
  7283. -0.2702 -0.2670 1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0
  7284. -1.2785 -0.0351 0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0
  7285. -0.9129 0.2741 -1.1088 C 0 0 0 0 0 0 0 0 0 0 0 0
  7286. 0.3682 0.3639 -1.5280 N 0 0 0 0 0 0 0 0 0 0 0 0
  7287. 1.3253 0.1335 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0
  7288. 1.0589 -0.1819 0.7199 C 0 0 0 0 0 0 0 0 0 0 0 0
  7289. -0.5180 -0.5120 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  7290. -2.3238 -0.0937 0.4727 H 0 0 0 0 0 0 0 0 0 0 0 0
  7291. -1.6631 0.4635 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0
  7292. 2.3464 0.2117 -0.9648 H 0 0 0 0 0 0 0 0 0 0 0 0
  7293. 1.8678 -0.3570 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  7294. 1 2 2 0
  7295. 2 3 1 0
  7296. 3 4 2 0
  7297. 4 5 1 0
  7298. 5 6 2 0
  7299. 6 1 1 0
  7300. 1 7 1 0
  7301. 2 8 1 0
  7302. 3 9 1 0
  7303. 5 10 1 0
  7304. 6 11 1 0
  7305. M END
  7306. $$$$
  7307. RDKit 3D
  7308. 11 11 0 0 0 0 0 0 0 0999 V2000
  7309. -0.2702 -0.2741 1.1196 C 0 0 0 0 0 0 0 0 0 0 0 0
  7310. -1.2785 -0.0363 0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0
  7311. -0.9129 0.2810 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  7312. 0.3682 0.3735 -1.5257 N 0 0 0 0 0 0 0 0 0 0 0 0
  7313. 1.3253 0.1373 -0.6021 C 0 0 0 0 0 0 0 0 0 0 0 0
  7314. 1.0589 -0.1864 0.7188 C 0 0 0 0 0 0 0 0 0 0 0 0
  7315. -0.5180 -0.5255 2.1467 H 0 0 0 0 0 0 0 0 0 0 0 0
  7316. -2.3238 -0.0967 0.4721 H 0 0 0 0 0 0 0 0 0 0 0 0
  7317. -1.6631 0.4753 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0
  7318. 2.3464 0.2178 -0.9635 H 0 0 0 0 0 0 0 0 0 0 0 0
  7319. 1.8678 -0.3659 1.4177 H 0 0 0 0 0 0 0 0 0 0 0 0
  7320. 1 2 2 0
  7321. 2 3 1 0
  7322. 3 4 2 0
  7323. 4 5 1 0
  7324. 5 6 2 0
  7325. 6 1 1 0
  7326. 1 7 1 0
  7327. 2 8 1 0
  7328. 3 9 1 0
  7329. 5 10 1 0
  7330. 6 11 1 0
  7331. M END
  7332. $$$$
  7333. RDKit 3D
  7334. 11 11 0 0 0 0 0 0 0 0999 V2000
  7335. -0.2702 -0.2811 1.1178 C 0 0 0 0 0 0 0 0 0 0 0 0
  7336. -1.2785 -0.0376 0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0
  7337. -0.9129 0.2880 -1.1052 C 0 0 0 0 0 0 0 0 0 0 0 0
  7338. 0.3682 0.3830 -1.5233 N 0 0 0 0 0 0 0 0 0 0 0 0
  7339. 1.3253 0.1411 -0.6012 C 0 0 0 0 0 0 0 0 0 0 0 0
  7340. 1.0589 -0.1910 0.7176 C 0 0 0 0 0 0 0 0 0 0 0 0
  7341. -0.5180 -0.5389 2.1434 H 0 0 0 0 0 0 0 0 0 0 0 0
  7342. -2.3238 -0.0997 0.4715 H 0 0 0 0 0 0 0 0 0 0 0 0
  7343. -1.6631 0.4870 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0
  7344. 2.3464 0.2239 -0.9621 H 0 0 0 0 0 0 0 0 0 0 0 0
  7345. 1.8678 -0.3748 1.4154 H 0 0 0 0 0 0 0 0 0 0 0 0
  7346. 1 2 2 0
  7347. 2 3 1 0
  7348. 3 4 2 0
  7349. 4 5 1 0
  7350. 5 6 2 0
  7351. 6 1 1 0
  7352. 1 7 1 0
  7353. 2 8 1 0
  7354. 3 9 1 0
  7355. 5 10 1 0
  7356. 6 11 1 0
  7357. M END
  7358. $$$$
  7359. RDKit 3D
  7360. 11 11 0 0 0 0 0 0 0 0999 V2000
  7361. -0.2702 -0.2881 1.1161 C 0 0 0 0 0 0 0 0 0 0 0 0
  7362. -1.2785 -0.0388 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
  7363. -0.9129 0.2949 -1.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
  7364. 0.3682 0.3926 -1.5209 N 0 0 0 0 0 0 0 0 0 0 0 0
  7365. 1.3253 0.1449 -0.6003 C 0 0 0 0 0 0 0 0 0 0 0 0
  7366. 1.0589 -0.1955 0.7164 C 0 0 0 0 0 0 0 0 0 0 0 0
  7367. -0.5180 -0.5524 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  7368. -2.3238 -0.1026 0.4708 H 0 0 0 0 0 0 0 0 0 0 0 0
  7369. -1.6631 0.4987 -1.8619 H 0 0 0 0 0 0 0 0 0 0 0 0
  7370. 2.3464 0.2299 -0.9607 H 0 0 0 0 0 0 0 0 0 0 0 0
  7371. 1.8678 -0.3837 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  7372. 1 2 2 0
  7373. 2 3 1 0
  7374. 3 4 2 0
  7375. 4 5 1 0
  7376. 5 6 2 0
  7377. 6 1 1 0
  7378. 1 7 1 0
  7379. 2 8 1 0
  7380. 3 9 1 0
  7381. 5 10 1 0
  7382. 6 11 1 0
  7383. M END
  7384. $$$$
  7385. RDKit 3D
  7386. 11 11 0 0 0 0 0 0 0 0999 V2000
  7387. -0.2702 -0.2951 1.1142 C 0 0 0 0 0 0 0 0 0 0 0 0
  7388. -1.2785 -0.0400 0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0
  7389. -0.9129 0.3019 -1.1015 C 0 0 0 0 0 0 0 0 0 0 0 0
  7390. 0.3682 0.4021 -1.5184 N 0 0 0 0 0 0 0 0 0 0 0 0
  7391. 1.3253 0.1486 -0.5994 C 0 0 0 0 0 0 0 0 0 0 0 0
  7392. 1.0589 -0.2000 0.7151 C 0 0 0 0 0 0 0 0 0 0 0 0
  7393. -0.5180 -0.5658 2.1364 H 0 0 0 0 0 0 0 0 0 0 0 0
  7394. -2.3238 -0.1056 0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0
  7395. -1.6631 0.5104 -1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0
  7396. 2.3464 0.2359 -0.9592 H 0 0 0 0 0 0 0 0 0 0 0 0
  7397. 1.8678 -0.3925 1.4106 H 0 0 0 0 0 0 0 0 0 0 0 0
  7398. 1 2 2 0
  7399. 2 3 1 0
  7400. 3 4 2 0
  7401. 4 5 1 0
  7402. 5 6 2 0
  7403. 6 1 1 0
  7404. 1 7 1 0
  7405. 2 8 1 0
  7406. 3 9 1 0
  7407. 5 10 1 0
  7408. 6 11 1 0
  7409. M END
  7410. $$$$
  7411. RDKit 3D
  7412. 11 11 0 0 0 0 0 0 0 0999 V2000
  7413. -0.2702 -0.3021 1.1123 C 0 0 0 0 0 0 0 0 0 0 0 0
  7414. -1.2785 -0.0411 0.1905 C 0 0 0 0 0 0 0 0 0 0 0 0
  7415. -0.9129 0.3088 -1.0996 C 0 0 0 0 0 0 0 0 0 0 0 0
  7416. 0.3682 0.4117 -1.5158 N 0 0 0 0 0 0 0 0 0 0 0 0
  7417. 1.3253 0.1524 -0.5985 C 0 0 0 0 0 0 0 0 0 0 0 0
  7418. 1.0589 -0.2044 0.7138 C 0 0 0 0 0 0 0 0 0 0 0 0
  7419. -0.5180 -0.5793 2.1328 H 0 0 0 0 0 0 0 0 0 0 0 0
  7420. -2.3238 -0.1085 0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0
  7421. -1.6631 0.5221 -1.8555 H 0 0 0 0 0 0 0 0 0 0 0 0
  7422. 2.3464 0.2419 -0.9577 H 0 0 0 0 0 0 0 0 0 0 0 0
  7423. 1.8678 -0.4014 1.4081 H 0 0 0 0 0 0 0 0 0 0 0 0
  7424. 1 2 2 0
  7425. 2 3 1 0
  7426. 3 4 2 0
  7427. 4 5 1 0
  7428. 5 6 2 0
  7429. 6 1 1 0
  7430. 1 7 1 0
  7431. 2 8 1 0
  7432. 3 9 1 0
  7433. 5 10 1 0
  7434. 6 11 1 0
  7435. M END
  7436. $$$$
  7437. RDKit 3D
  7438. 11 11 0 0 0 0 0 0 0 0999 V2000
  7439. -0.2702 -0.3091 1.1104 C 0 0 0 0 0 0 0 0 0 0 0 0
  7440. -1.2785 -0.0423 0.1902 C 0 0 0 0 0 0 0 0 0 0 0 0
  7441. -0.9129 0.3157 -1.0977 C 0 0 0 0 0 0 0 0 0 0 0 0
  7442. 0.3682 0.4212 -1.5132 N 0 0 0 0 0 0 0 0 0 0 0 0
  7443. 1.3253 0.1562 -0.5975 C 0 0 0 0 0 0 0 0 0 0 0 0
  7444. 1.0589 -0.2089 0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0
  7445. -0.5180 -0.5926 2.1292 H 0 0 0 0 0 0 0 0 0 0 0 0
  7446. -2.3238 -0.1115 0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0
  7447. -1.6631 0.5337 -1.8522 H 0 0 0 0 0 0 0 0 0 0 0 0
  7448. 2.3464 0.2480 -0.9562 H 0 0 0 0 0 0 0 0 0 0 0 0
  7449. 1.8678 -0.4102 1.4055 H 0 0 0 0 0 0 0 0 0 0 0 0
  7450. 1 2 2 0
  7451. 2 3 1 0
  7452. 3 4 2 0
  7453. 4 5 1 0
  7454. 5 6 2 0
  7455. 6 1 1 0
  7456. 1 7 1 0
  7457. 2 8 1 0
  7458. 3 9 1 0
  7459. 5 10 1 0
  7460. 6 11 1 0
  7461. M END
  7462. $$$$
  7463. RDKit 3D
  7464. 11 11 0 0 0 0 0 0 0 0999 V2000
  7465. -0.2702 -0.3161 1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0
  7466. -1.2785 -0.0435 0.1899 C 0 0 0 0 0 0 0 0 0 0 0 0
  7467. -0.9129 0.3226 -1.0957 C 0 0 0 0 0 0 0 0 0 0 0 0
  7468. 0.3682 0.4307 -1.5105 N 0 0 0 0 0 0 0 0 0 0 0 0
  7469. 1.3253 0.1599 -0.5965 C 0 0 0 0 0 0 0 0 0 0 0 0
  7470. 1.0589 -0.2134 0.7112 C 0 0 0 0 0 0 0 0 0 0 0 0
  7471. -0.5180 -0.6060 2.1254 H 0 0 0 0 0 0 0 0 0 0 0 0
  7472. -2.3238 -0.1144 0.4681 H 0 0 0 0 0 0 0 0 0 0 0 0
  7473. -1.6631 0.5454 -1.8488 H 0 0 0 0 0 0 0 0 0 0 0 0
  7474. 2.3464 0.2540 -0.9546 H 0 0 0 0 0 0 0 0 0 0 0 0
  7475. 1.8678 -0.4190 1.4029 H 0 0 0 0 0 0 0 0 0 0 0 0
  7476. 1 2 2 0
  7477. 2 3 1 0
  7478. 3 4 2 0
  7479. 4 5 1 0
  7480. 5 6 2 0
  7481. 6 1 1 0
  7482. 1 7 1 0
  7483. 2 8 1 0
  7484. 3 9 1 0
  7485. 5 10 1 0
  7486. 6 11 1 0
  7487. M END
  7488. $$$$
  7489. RDKit 3D
  7490. 11 11 0 0 0 0 0 0 0 0999 V2000
  7491. -0.2702 -0.3230 1.1065 C 0 0 0 0 0 0 0 0 0 0 0 0
  7492. -1.2785 -0.0447 0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0
  7493. -0.9129 0.3294 -1.0936 C 0 0 0 0 0 0 0 0 0 0 0 0
  7494. 0.3682 0.4402 -1.5078 N 0 0 0 0 0 0 0 0 0 0 0 0
  7495. 1.3253 0.1637 -0.5955 C 0 0 0 0 0 0 0 0 0 0 0 0
  7496. 1.0589 -0.2179 0.7099 C 0 0 0 0 0 0 0 0 0 0 0 0
  7497. -0.5180 -0.6193 2.1216 H 0 0 0 0 0 0 0 0 0 0 0 0
  7498. -2.3238 -0.1174 0.4674 H 0 0 0 0 0 0 0 0 0 0 0 0
  7499. -1.6631 0.5570 -1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0
  7500. 2.3464 0.2600 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  7501. 1.8678 -0.4279 1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
  7502. 1 2 2 0
  7503. 2 3 1 0
  7504. 3 4 2 0
  7505. 4 5 1 0
  7506. 5 6 2 0
  7507. 6 1 1 0
  7508. 1 7 1 0
  7509. 2 8 1 0
  7510. 3 9 1 0
  7511. 5 10 1 0
  7512. 6 11 1 0
  7513. M END
  7514. $$$$
  7515. RDKit 3D
  7516. 11 11 0 0 0 0 0 0 0 0999 V2000
  7517. -0.2702 -0.3300 1.1044 C 0 0 0 0 0 0 0 0 0 0 0 0
  7518. -1.2785 -0.0459 0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0
  7519. -0.9129 0.3363 -1.0915 C 0 0 0 0 0 0 0 0 0 0 0 0
  7520. 0.3682 0.4496 -1.5050 N 0 0 0 0 0 0 0 0 0 0 0 0
  7521. 1.3253 0.1674 -0.5944 C 0 0 0 0 0 0 0 0 0 0 0 0
  7522. 1.0589 -0.2223 0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0
  7523. -0.5180 -0.6327 2.1176 H 0 0 0 0 0 0 0 0 0 0 0 0
  7524. -2.3238 -0.1203 0.4666 H 0 0 0 0 0 0 0 0 0 0 0 0
  7525. -1.6631 0.5685 -1.8418 H 0 0 0 0 0 0 0 0 0 0 0 0
  7526. 2.3464 0.2659 -0.9513 H 0 0 0 0 0 0 0 0 0 0 0 0
  7527. 1.8678 -0.4366 1.3975 H 0 0 0 0 0 0 0 0 0 0 0 0
  7528. 1 2 2 0
  7529. 2 3 1 0
  7530. 3 4 2 0
  7531. 4 5 1 0
  7532. 5 6 2 0
  7533. 6 1 1 0
  7534. 1 7 1 0
  7535. 2 8 1 0
  7536. 3 9 1 0
  7537. 5 10 1 0
  7538. 6 11 1 0
  7539. M END
  7540. $$$$
  7541. RDKit 3D
  7542. 11 11 0 0 0 0 0 0 0 0999 V2000
  7543. -0.2702 -0.3369 1.1023 C 0 0 0 0 0 0 0 0 0 0 0 0
  7544. -1.2785 -0.0471 0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0
  7545. -0.9129 0.3432 -1.0894 C 0 0 0 0 0 0 0 0 0 0 0 0
  7546. 0.3682 0.4591 -1.5021 N 0 0 0 0 0 0 0 0 0 0 0 0
  7547. 1.3253 0.1711 -0.5934 C 0 0 0 0 0 0 0 0 0 0 0 0
  7548. 1.0589 -0.2268 0.7071 C 0 0 0 0 0 0 0 0 0 0 0 0
  7549. -0.5180 -0.6460 2.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
  7550. -2.3238 -0.1232 0.4659 H 0 0 0 0 0 0 0 0 0 0 0 0
  7551. -1.6631 0.5801 -1.8382 H 0 0 0 0 0 0 0 0 0 0 0 0
  7552. 2.3464 0.2719 -0.9496 H 0 0 0 0 0 0 0 0 0 0 0 0
  7553. 1.8678 -0.4454 1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0
  7554. 1 2 2 0
  7555. 2 3 1 0
  7556. 3 4 2 0
  7557. 4 5 1 0
  7558. 5 6 2 0
  7559. 6 1 1 0
  7560. 1 7 1 0
  7561. 2 8 1 0
  7562. 3 9 1 0
  7563. 5 10 1 0
  7564. 6 11 1 0
  7565. M END
  7566. $$$$
  7567. RDKit 3D
  7568. 11 11 0 0 0 0 0 0 0 0999 V2000
  7569. -0.2702 -0.3438 1.1002 C 0 0 0 0 0 0 0 0 0 0 0 0
  7570. -1.2785 -0.0483 0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0
  7571. -0.9129 0.3500 -1.0872 C 0 0 0 0 0 0 0 0 0 0 0 0
  7572. 0.3682 0.4685 -1.4992 N 0 0 0 0 0 0 0 0 0 0 0 0
  7573. 1.3253 0.1748 -0.5923 C 0 0 0 0 0 0 0 0 0 0 0 0
  7574. 1.0589 -0.2312 0.7056 C 0 0 0 0 0 0 0 0 0 0 0 0
  7575. -0.5180 -0.6592 2.1095 H 0 0 0 0 0 0 0 0 0 0 0 0
  7576. -2.3238 -0.1262 0.4651 H 0 0 0 0 0 0 0 0 0 0 0 0
  7577. -1.6631 0.5916 -1.8345 H 0 0 0 0 0 0 0 0 0 0 0 0
  7578. 2.3464 0.2779 -0.9479 H 0 0 0 0 0 0 0 0 0 0 0 0
  7579. 1.8678 -0.4542 1.3919 H 0 0 0 0 0 0 0 0 0 0 0 0
  7580. 1 2 2 0
  7581. 2 3 1 0
  7582. 3 4 2 0
  7583. 4 5 1 0
  7584. 5 6 2 0
  7585. 6 1 1 0
  7586. 1 7 1 0
  7587. 2 8 1 0
  7588. 3 9 1 0
  7589. 5 10 1 0
  7590. 6 11 1 0
  7591. M END
  7592. $$$$
  7593. RDKit 3D
  7594. 11 11 0 0 0 0 0 0 0 0999 V2000
  7595. -0.2702 -0.3507 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  7596. -1.2785 -0.0495 0.1885 C 0 0 0 0 0 0 0 0 0 0 0 0
  7597. -0.9129 0.3568 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  7598. 0.3682 0.4779 -1.4963 N 0 0 0 0 0 0 0 0 0 0 0 0
  7599. 1.3253 0.1786 -0.5912 C 0 0 0 0 0 0 0 0 0 0 0 0
  7600. 1.0589 -0.2356 0.7042 C 0 0 0 0 0 0 0 0 0 0 0 0
  7601. -0.5180 -0.6725 2.1053 H 0 0 0 0 0 0 0 0 0 0 0 0
  7602. -2.3238 -0.1291 0.4643 H 0 0 0 0 0 0 0 0 0 0 0 0
  7603. -1.6631 0.6032 -1.8307 H 0 0 0 0 0 0 0 0 0 0 0 0
  7604. 2.3464 0.2838 -0.9461 H 0 0 0 0 0 0 0 0 0 0 0 0
  7605. 1.8678 -0.4629 1.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
  7606. 1 2 2 0
  7607. 2 3 1 0
  7608. 3 4 2 0
  7609. 4 5 1 0
  7610. 5 6 2 0
  7611. 6 1 1 0
  7612. 1 7 1 0
  7613. 2 8 1 0
  7614. 3 9 1 0
  7615. 5 10 1 0
  7616. 6 11 1 0
  7617. M END
  7618. $$$$
  7619. RDKit 3D
  7620. 11 11 0 0 0 0 0 0 0 0999 V2000
  7621. -0.2702 -0.3576 1.0958 C 0 0 0 0 0 0 0 0 0 0 0 0
  7622. -1.2785 -0.0507 0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0
  7623. -0.9129 0.3636 -1.0827 C 0 0 0 0 0 0 0 0 0 0 0 0
  7624. 0.3682 0.4873 -1.4932 N 0 0 0 0 0 0 0 0 0 0 0 0
  7625. 1.3253 0.1823 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0
  7626. 1.0589 -0.2401 0.7027 C 0 0 0 0 0 0 0 0 0 0 0 0
  7627. -0.5180 -0.6857 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7628. -2.3238 -0.1320 0.4635 H 0 0 0 0 0 0 0 0 0 0 0 0
  7629. -1.6631 0.6146 -1.8269 H 0 0 0 0 0 0 0 0 0 0 0 0
  7630. 2.3464 0.2898 -0.9443 H 0 0 0 0 0 0 0 0 0 0 0 0
  7631. 1.8678 -0.4716 1.3861 H 0 0 0 0 0 0 0 0 0 0 0 0
  7632. 1 2 2 0
  7633. 2 3 1 0
  7634. 3 4 2 0
  7635. 4 5 1 0
  7636. 5 6 2 0
  7637. 6 1 1 0
  7638. 1 7 1 0
  7639. 2 8 1 0
  7640. 3 9 1 0
  7641. 5 10 1 0
  7642. 6 11 1 0
  7643. M END
  7644. $$$$
  7645. RDKit 3D
  7646. 11 11 0 0 0 0 0 0 0 0999 V2000
  7647. -0.2702 -0.3645 1.0935 C 0 0 0 0 0 0 0 0 0 0 0 0
  7648. -1.2785 -0.0518 0.1878 C 0 0 0 0 0 0 0 0 0 0 0 0
  7649. -0.9129 0.3704 -1.0804 C 0 0 0 0 0 0 0 0 0 0 0 0
  7650. 0.3682 0.4967 -1.4901 N 0 0 0 0 0 0 0 0 0 0 0 0
  7651. 1.3253 0.1860 -0.5889 C 0 0 0 0 0 0 0 0 0 0 0 0
  7652. 1.0589 -0.2445 0.7011 C 0 0 0 0 0 0 0 0 0 0 0 0
  7653. -0.5180 -0.6989 2.0967 H 0 0 0 0 0 0 0 0 0 0 0 0
  7654. -2.3238 -0.1349 0.4626 H 0 0 0 0 0 0 0 0 0 0 0 0
  7655. -1.6631 0.6261 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0
  7656. 2.3464 0.2957 -0.9425 H 0 0 0 0 0 0 0 0 0 0 0 0
  7657. 1.8678 -0.4803 1.3831 H 0 0 0 0 0 0 0 0 0 0 0 0
  7658. 1 2 2 0
  7659. 2 3 1 0
  7660. 3 4 2 0
  7661. 4 5 1 0
  7662. 5 6 2 0
  7663. 6 1 1 0
  7664. 1 7 1 0
  7665. 2 8 1 0
  7666. 3 9 1 0
  7667. 5 10 1 0
  7668. 6 11 1 0
  7669. M END
  7670. $$$$
  7671. RDKit 3D
  7672. 11 11 0 0 0 0 0 0 0 0999 V2000
  7673. -0.2702 -0.3713 1.0912 C 0 0 0 0 0 0 0 0 0 0 0 0
  7674. -1.2785 -0.0530 0.1875 C 0 0 0 0 0 0 0 0 0 0 0 0
  7675. -0.9129 0.3772 -1.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
  7676. 0.3682 0.5060 -1.4870 N 0 0 0 0 0 0 0 0 0 0 0 0
  7677. 1.3253 0.1897 -0.5877 C 0 0 0 0 0 0 0 0 0 0 0 0
  7678. 1.0589 -0.2489 0.6996 C 0 0 0 0 0 0 0 0 0 0 0 0
  7679. -0.5180 -0.7120 2.0923 H 0 0 0 0 0 0 0 0 0 0 0 0
  7680. -2.3238 -0.1378 0.4618 H 0 0 0 0 0 0 0 0 0 0 0 0
  7681. -1.6631 0.6376 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
  7682. 2.3464 0.3016 -0.9406 H 0 0 0 0 0 0 0 0 0 0 0 0
  7683. 1.8678 -0.4890 1.3801 H 0 0 0 0 0 0 0 0 0 0 0 0
  7684. 1 2 2 0
  7685. 2 3 1 0
  7686. 3 4 2 0
  7687. 4 5 1 0
  7688. 5 6 2 0
  7689. 6 1 1 0
  7690. 1 7 1 0
  7691. 2 8 1 0
  7692. 3 9 1 0
  7693. 5 10 1 0
  7694. 6 11 1 0
  7695. M END
  7696. $$$$
  7697. RDKit 3D
  7698. 11 11 0 0 0 0 0 0 0 0999 V2000
  7699. -0.2702 -0.3782 1.0888 C 0 0 0 0 0 0 0 0 0 0 0 0
  7700. -1.2785 -0.0542 0.1872 C 0 0 0 0 0 0 0 0 0 0 0 0
  7701. -0.9129 0.3840 -1.0757 C 0 0 0 0 0 0 0 0 0 0 0 0
  7702. 0.3682 0.5154 -1.4838 N 0 0 0 0 0 0 0 0 0 0 0 0
  7703. 1.3253 0.1934 -0.5865 C 0 0 0 0 0 0 0 0 0 0 0 0
  7704. 1.0589 -0.2533 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0
  7705. -0.5180 -0.7252 2.0878 H 0 0 0 0 0 0 0 0 0 0 0 0
  7706. -2.3238 -0.1407 0.4609 H 0 0 0 0 0 0 0 0 0 0 0 0
  7707. -1.6631 0.6490 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0
  7708. 2.3464 0.3075 -0.9387 H 0 0 0 0 0 0 0 0 0 0 0 0
  7709. 1.8678 -0.4977 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0
  7710. 1 2 2 0
  7711. 2 3 1 0
  7712. 3 4 2 0
  7713. 4 5 1 0
  7714. 5 6 2 0
  7715. 6 1 1 0
  7716. 1 7 1 0
  7717. 2 8 1 0
  7718. 3 9 1 0
  7719. 5 10 1 0
  7720. 6 11 1 0
  7721. M END
  7722. $$$$
  7723. RDKit 3D
  7724. 11 11 0 0 0 0 0 0 0 0999 V2000
  7725. -0.2702 -0.3850 1.0864 C 0 0 0 0 0 0 0 0 0 0 0 0
  7726. -1.2785 -0.0554 0.1868 C 0 0 0 0 0 0 0 0 0 0 0 0
  7727. -0.9129 0.3907 -1.0732 C 0 0 0 0 0 0 0 0 0 0 0 0
  7728. 0.3682 0.5247 -1.4805 N 0 0 0 0 0 0 0 0 0 0 0 0
  7729. 1.3253 0.1970 -0.5853 C 0 0 0 0 0 0 0 0 0 0 0 0
  7730. 1.0589 -0.2576 0.6964 C 0 0 0 0 0 0 0 0 0 0 0 0
  7731. -0.5180 -0.7383 2.0832 H 0 0 0 0 0 0 0 0 0 0 0 0
  7732. -2.3238 -0.1436 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0
  7733. -1.6631 0.6604 -1.8109 H 0 0 0 0 0 0 0 0 0 0 0 0
  7734. 2.3464 0.3134 -0.9368 H 0 0 0 0 0 0 0 0 0 0 0 0
  7735. 1.8678 -0.5063 1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0
  7736. 1 2 2 0
  7737. 2 3 1 0
  7738. 3 4 2 0
  7739. 4 5 1 0
  7740. 5 6 2 0
  7741. 6 1 1 0
  7742. 1 7 1 0
  7743. 2 8 1 0
  7744. 3 9 1 0
  7745. 5 10 1 0
  7746. 6 11 1 0
  7747. M END
  7748. $$$$
  7749. RDKit 3D
  7750. 11 11 0 0 0 0 0 0 0 0999 V2000
  7751. -0.2702 -0.3918 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
  7752. -1.2785 -0.0566 0.1865 C 0 0 0 0 0 0 0 0 0 0 0 0
  7753. -0.9129 0.3975 -1.0708 C 0 0 0 0 0 0 0 0 0 0 0 0
  7754. 0.3682 0.5340 -1.4772 N 0 0 0 0 0 0 0 0 0 0 0 0
  7755. 1.3253 0.2007 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0
  7756. 1.0589 -0.2620 0.6948 C 0 0 0 0 0 0 0 0 0 0 0 0
  7757. -0.5180 -0.7513 2.0785 H 0 0 0 0 0 0 0 0 0 0 0 0
  7758. -2.3238 -0.1465 0.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
  7759. -1.6631 0.6717 -1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0
  7760. 2.3464 0.3193 -0.9348 H 0 0 0 0 0 0 0 0 0 0 0 0
  7761. 1.8678 -0.5149 1.3706 H 0 0 0 0 0 0 0 0 0 0 0 0
  7762. 1 2 2 0
  7763. 2 3 1 0
  7764. 3 4 2 0
  7765. 4 5 1 0
  7766. 5 6 2 0
  7767. 6 1 1 0
  7768. 1 7 1 0
  7769. 2 8 1 0
  7770. 3 9 1 0
  7771. 5 10 1 0
  7772. 6 11 1 0
  7773. M END
  7774. $$$$
  7775. RDKit 3D
  7776. 11 11 0 0 0 0 0 0 0 0999 V2000
  7777. -0.2702 -0.3987 1.0815 C 0 0 0 0 0 0 0 0 0 0 0 0
  7778. -1.2785 -0.0577 0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0
  7779. -0.9129 0.4042 -1.0682 C 0 0 0 0 0 0 0 0 0 0 0 0
  7780. 0.3682 0.5433 -1.4738 N 0 0 0 0 0 0 0 0 0 0 0 0
  7781. 1.3253 0.2044 -0.5828 C 0 0 0 0 0 0 0 0 0 0 0 0
  7782. 1.0589 -0.2664 0.6931 C 0 0 0 0 0 0 0 0 0 0 0 0
  7783. -0.5180 -0.7644 2.0737 H 0 0 0 0 0 0 0 0 0 0 0 0
  7784. -2.3238 -0.1494 0.4582 H 0 0 0 0 0 0 0 0 0 0 0 0
  7785. -1.6631 0.6831 -1.8024 H 0 0 0 0 0 0 0 0 0 0 0 0
  7786. 2.3464 0.3251 -0.9327 H 0 0 0 0 0 0 0 0 0 0 0 0
  7787. 1.8678 -0.5235 1.3674 H 0 0 0 0 0 0 0 0 0 0 0 0
  7788. 1 2 2 0
  7789. 2 3 1 0
  7790. 3 4 2 0
  7791. 4 5 1 0
  7792. 5 6 2 0
  7793. 6 1 1 0
  7794. 1 7 1 0
  7795. 2 8 1 0
  7796. 3 9 1 0
  7797. 5 10 1 0
  7798. 6 11 1 0
  7799. M END
  7800. $$$$
  7801. RDKit 3D
  7802. 11 11 0 0 0 0 0 0 0 0999 V2000
  7803. -0.2702 -0.4054 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
  7804. -1.2785 -0.0589 0.1857 C 0 0 0 0 0 0 0 0 0 0 0 0
  7805. -0.9129 0.4109 -1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0
  7806. 0.3682 0.5525 -1.4703 N 0 0 0 0 0 0 0 0 0 0 0 0
  7807. 1.3253 0.2080 -0.5815 C 0 0 0 0 0 0 0 0 0 0 0 0
  7808. 1.0589 -0.2707 0.6914 C 0 0 0 0 0 0 0 0 0 0 0 0
  7809. -0.5180 -0.7774 2.0689 H 0 0 0 0 0 0 0 0 0 0 0 0
  7810. -2.3238 -0.1522 0.4572 H 0 0 0 0 0 0 0 0 0 0 0 0
  7811. -1.6631 0.6944 -1.7981 H 0 0 0 0 0 0 0 0 0 0 0 0
  7812. 2.3464 0.3310 -0.9307 H 0 0 0 0 0 0 0 0 0 0 0 0
  7813. 1.8678 -0.5321 1.3641 H 0 0 0 0 0 0 0 0 0 0 0 0
  7814. 1 2 2 0
  7815. 2 3 1 0
  7816. 3 4 2 0
  7817. 4 5 1 0
  7818. 5 6 2 0
  7819. 6 1 1 0
  7820. 1 7 1 0
  7821. 2 8 1 0
  7822. 3 9 1 0
  7823. 5 10 1 0
  7824. 6 11 1 0
  7825. M END
  7826. $$$$
  7827. RDKit 3D
  7828. 11 11 0 0 0 0 0 0 0 0999 V2000
  7829. -0.2702 -0.4122 1.0764 C 0 0 0 0 0 0 0 0 0 0 0 0
  7830. -1.2785 -0.0601 0.1854 C 0 0 0 0 0 0 0 0 0 0 0 0
  7831. -0.9129 0.4176 -1.0631 C 0 0 0 0 0 0 0 0 0 0 0 0
  7832. 0.3682 0.5617 -1.4668 N 0 0 0 0 0 0 0 0 0 0 0 0
  7833. 1.3253 0.2117 -0.5801 C 0 0 0 0 0 0 0 0 0 0 0 0
  7834. 1.0589 -0.2751 0.6897 C 0 0 0 0 0 0 0 0 0 0 0 0
  7835. -0.5180 -0.7904 2.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
  7836. -2.3238 -0.1551 0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0
  7837. -1.6631 0.7057 -1.7937 H 0 0 0 0 0 0 0 0 0 0 0 0
  7838. 2.3464 0.3368 -0.9286 H 0 0 0 0 0 0 0 0 0 0 0 0
  7839. 1.8678 -0.5407 1.3607 H 0 0 0 0 0 0 0 0 0 0 0 0
  7840. 1 2 2 0
  7841. 2 3 1 0
  7842. 3 4 2 0
  7843. 4 5 1 0
  7844. 5 6 2 0
  7845. 6 1 1 0
  7846. 1 7 1 0
  7847. 2 8 1 0
  7848. 3 9 1 0
  7849. 5 10 1 0
  7850. 6 11 1 0
  7851. M END
  7852. $$$$
  7853. RDKit 3D
  7854. 11 11 0 0 0 0 0 0 0 0999 V2000
  7855. -0.2702 -0.4190 1.0738 C 0 0 0 0 0 0 0 0 0 0 0 0
  7856. -1.2785 -0.0612 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
  7857. -0.9129 0.4242 -1.0604 C 0 0 0 0 0 0 0 0 0 0 0 0
  7858. 0.3682 0.5709 -1.4633 N 0 0 0 0 0 0 0 0 0 0 0 0
  7859. 1.3253 0.2153 -0.5788 C 0 0 0 0 0 0 0 0 0 0 0 0
  7860. 1.0589 -0.2794 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
  7861. -0.5180 -0.8033 2.0589 H 0 0 0 0 0 0 0 0 0 0 0 0
  7862. -2.3238 -0.1580 0.4553 H 0 0 0 0 0 0 0 0 0 0 0 0
  7863. -1.6631 0.7169 -1.7893 H 0 0 0 0 0 0 0 0 0 0 0 0
  7864. 2.3464 0.3427 -0.9264 H 0 0 0 0 0 0 0 0 0 0 0 0
  7865. 1.8678 -0.5492 1.3573 H 0 0 0 0 0 0 0 0 0 0 0 0
  7866. 1 2 2 0
  7867. 2 3 1 0
  7868. 3 4 2 0
  7869. 4 5 1 0
  7870. 5 6 2 0
  7871. 6 1 1 0
  7872. 1 7 1 0
  7873. 2 8 1 0
  7874. 3 9 1 0
  7875. 5 10 1 0
  7876. 6 11 1 0
  7877. M END
  7878. $$$$
  7879. RDKit 3D
  7880. 11 11 0 0 0 0 0 0 0 0999 V2000
  7881. -0.2702 -0.4257 1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0
  7882. -1.2785 -0.0624 0.1846 C 0 0 0 0 0 0 0 0 0 0 0 0
  7883. -0.9129 0.4309 -1.0578 C 0 0 0 0 0 0 0 0 0 0 0 0
  7884. 0.3682 0.5801 -1.4597 N 0 0 0 0 0 0 0 0 0 0 0 0
  7885. 1.3253 0.2190 -0.5774 C 0 0 0 0 0 0 0 0 0 0 0 0
  7886. 1.0589 -0.2837 0.6862 C 0 0 0 0 0 0 0 0 0 0 0 0
  7887. -0.5180 -0.8163 2.0538 H 0 0 0 0 0 0 0 0 0 0 0 0
  7888. -2.3238 -0.1608 0.4543 H 0 0 0 0 0 0 0 0 0 0 0 0
  7889. -1.6631 0.7281 -1.7847 H 0 0 0 0 0 0 0 0 0 0 0 0
  7890. 2.3464 0.3485 -0.9243 H 0 0 0 0 0 0 0 0 0 0 0 0
  7891. 1.8678 -0.5577 1.3538 H 0 0 0 0 0 0 0 0 0 0 0 0
  7892. 1 2 2 0
  7893. 2 3 1 0
  7894. 3 4 2 0
  7895. 4 5 1 0
  7896. 5 6 2 0
  7897. 6 1 1 0
  7898. 1 7 1 0
  7899. 2 8 1 0
  7900. 3 9 1 0
  7901. 5 10 1 0
  7902. 6 11 1 0
  7903. M END
  7904. $$$$
  7905. RDKit 3D
  7906. 11 11 0 0 0 0 0 0 0 0999 V2000
  7907. -0.2702 -0.4324 1.0685 C 0 0 0 0 0 0 0 0 0 0 0 0
  7908. -1.2785 -0.0635 0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0
  7909. -0.9129 0.4375 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
  7910. 0.3682 0.5893 -1.4560 N 0 0 0 0 0 0 0 0 0 0 0 0
  7911. 1.3253 0.2226 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0
  7912. 1.0589 -0.2880 0.6844 C 0 0 0 0 0 0 0 0 0 0 0 0
  7913. -0.5180 -0.8291 2.0487 H 0 0 0 0 0 0 0 0 0 0 0 0
  7914. -2.3238 -0.1637 0.4532 H 0 0 0 0 0 0 0 0 0 0 0 0
  7915. -1.6631 0.7393 -1.7801 H 0 0 0 0 0 0 0 0 0 0 0 0
  7916. 2.3464 0.3543 -0.9221 H 0 0 0 0 0 0 0 0 0 0 0 0
  7917. 1.8678 -0.5662 1.3502 H 0 0 0 0 0 0 0 0 0 0 0 0
  7918. 1 2 2 0
  7919. 2 3 1 0
  7920. 3 4 2 0
  7921. 4 5 1 0
  7922. 5 6 2 0
  7923. 6 1 1 0
  7924. 1 7 1 0
  7925. 2 8 1 0
  7926. 3 9 1 0
  7927. 5 10 1 0
  7928. 6 11 1 0
  7929. M END
  7930. $$$$
  7931. RDKit 3D
  7932. 11 11 0 0 0 0 0 0 0 0999 V2000
  7933. -0.2702 -0.4391 1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0
  7934. -1.2785 -0.0647 0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0
  7935. -0.9129 0.4442 -1.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
  7936. 0.3682 0.5984 -1.4523 N 0 0 0 0 0 0 0 0 0 0 0 0
  7937. 1.3253 0.2262 -0.5746 C 0 0 0 0 0 0 0 0 0 0 0 0
  7938. 1.0589 -0.2923 0.6826 C 0 0 0 0 0 0 0 0 0 0 0 0
  7939. -0.5180 -0.8420 2.0434 H 0 0 0 0 0 0 0 0 0 0 0 0
  7940. -2.3238 -0.1665 0.4522 H 0 0 0 0 0 0 0 0 0 0 0 0
  7941. -1.6631 0.7505 -1.7754 H 0 0 0 0 0 0 0 0 0 0 0 0
  7942. 2.3464 0.3601 -0.9198 H 0 0 0 0 0 0 0 0 0 0 0 0
  7943. 1.8678 -0.5747 1.3467 H 0 0 0 0 0 0 0 0 0 0 0 0
  7944. 1 2 2 0
  7945. 2 3 1 0
  7946. 3 4 2 0
  7947. 4 5 1 0
  7948. 5 6 2 0
  7949. 6 1 1 0
  7950. 1 7 1 0
  7951. 2 8 1 0
  7952. 3 9 1 0
  7953. 5 10 1 0
  7954. 6 11 1 0
  7955. M END
  7956. $$$$
  7957. RDKit 3D
  7958. 11 11 0 0 0 0 0 0 0 0999 V2000
  7959. -0.2702 -0.4458 1.0629 C 0 0 0 0 0 0 0 0 0 0 0 0
  7960. -1.2785 -0.0658 0.1834 C 0 0 0 0 0 0 0 0 0 0 0 0
  7961. -0.9129 0.4508 -1.0494 C 0 0 0 0 0 0 0 0 0 0 0 0
  7962. 0.3682 0.6075 -1.4485 N 0 0 0 0 0 0 0 0 0 0 0 0
  7963. 1.3253 0.2298 -0.5732 C 0 0 0 0 0 0 0 0 0 0 0 0
  7964. 1.0589 -0.2966 0.6807 C 0 0 0 0 0 0 0 0 0 0 0 0
  7965. -0.5180 -0.8548 2.0381 H 0 0 0 0 0 0 0 0 0 0 0 0
  7966. -2.3238 -0.1694 0.4512 H 0 0 0 0 0 0 0 0 0 0 0 0
  7967. -1.6631 0.7617 -1.7707 H 0 0 0 0 0 0 0 0 0 0 0 0
  7968. 2.3464 0.3658 -0.9175 H 0 0 0 0 0 0 0 0 0 0 0 0
  7969. 1.8678 -0.5831 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0
  7970. 1 2 2 0
  7971. 2 3 1 0
  7972. 3 4 2 0
  7973. 4 5 1 0
  7974. 5 6 2 0
  7975. 6 1 1 0
  7976. 1 7 1 0
  7977. 2 8 1 0
  7978. 3 9 1 0
  7979. 5 10 1 0
  7980. 6 11 1 0
  7981. M END
  7982. $$$$
  7983. RDKit 3D
  7984. 11 11 0 0 0 0 0 0 0 0999 V2000
  7985. -0.2702 -0.4525 1.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
  7986. -1.2785 -0.0670 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0
  7987. -0.9129 0.4573 -1.0466 C 0 0 0 0 0 0 0 0 0 0 0 0
  7988. 0.3682 0.6166 -1.4446 N 0 0 0 0 0 0 0 0 0 0 0 0
  7989. 1.3253 0.2334 -0.5718 C 0 0 0 0 0 0 0 0 0 0 0 0
  7990. 1.0589 -0.3009 0.6789 C 0 0 0 0 0 0 0 0 0 0 0 0
  7991. -0.5180 -0.8676 2.0327 H 0 0 0 0 0 0 0 0 0 0 0 0
  7992. -2.3238 -0.1722 0.4501 H 0 0 0 0 0 0 0 0 0 0 0 0
  7993. -1.6631 0.7728 -1.7659 H 0 0 0 0 0 0 0 0 0 0 0 0
  7994. 2.3464 0.3716 -0.9152 H 0 0 0 0 0 0 0 0 0 0 0 0
  7995. 1.8678 -0.5916 1.3393 H 0 0 0 0 0 0 0 0 0 0 0 0
  7996. 1 2 2 0
  7997. 2 3 1 0
  7998. 3 4 2 0
  7999. 4 5 1 0
  8000. 5 6 2 0
  8001. 6 1 1 0
  8002. 1 7 1 0
  8003. 2 8 1 0
  8004. 3 9 1 0
  8005. 5 10 1 0
  8006. 6 11 1 0
  8007. M END
  8008. $$$$
  8009. RDKit 3D
  8010. 11 11 0 0 0 0 0 0 0 0999 V2000
  8011. -0.2702 -0.4591 1.0572 C 0 0 0 0 0 0 0 0 0 0 0 0
  8012. -1.2785 -0.0681 0.1825 C 0 0 0 0 0 0 0 0 0 0 0 0
  8013. -0.9129 0.4639 -1.0437 C 0 0 0 0 0 0 0 0 0 0 0 0
  8014. 0.3682 0.6257 -1.4407 N 0 0 0 0 0 0 0 0 0 0 0 0
  8015. 1.3253 0.2370 -0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0
  8016. 1.0589 -0.3051 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0
  8017. -0.5180 -0.8804 2.0272 H 0 0 0 0 0 0 0 0 0 0 0 0
  8018. -2.3238 -0.1750 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
  8019. -1.6631 0.7838 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0
  8020. 2.3464 0.3773 -0.9129 H 0 0 0 0 0 0 0 0 0 0 0 0
  8021. 1.8678 -0.6000 1.3356 H 0 0 0 0 0 0 0 0 0 0 0 0
  8022. 1 2 2 0
  8023. 2 3 1 0
  8024. 3 4 2 0
  8025. 4 5 1 0
  8026. 5 6 2 0
  8027. 6 1 1 0
  8028. 1 7 1 0
  8029. 2 8 1 0
  8030. 3 9 1 0
  8031. 5 10 1 0
  8032. 6 11 1 0
  8033. M END
  8034. $$$$
  8035. RDKit 3D
  8036. 11 11 0 0 0 0 0 0 0 0999 V2000
  8037. -0.2702 -0.4658 1.0543 C 0 0 0 0 0 0 0 0 0 0 0 0
  8038. -1.2785 -0.0693 0.1821 C 0 0 0 0 0 0 0 0 0 0 0 0
  8039. -0.9129 0.4705 -1.0408 C 0 0 0 0 0 0 0 0 0 0 0 0
  8040. 0.3682 0.6347 -1.4368 N 0 0 0 0 0 0 0 0 0 0 0 0
  8041. 1.3253 0.2406 -0.5688 C 0 0 0 0 0 0 0 0 0 0 0 0
  8042. 1.0589 -0.3094 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0
  8043. -0.5180 -0.8931 2.0216 H 0 0 0 0 0 0 0 0 0 0 0 0
  8044. -2.3238 -0.1778 0.4479 H 0 0 0 0 0 0 0 0 0 0 0 0
  8045. -1.6631 0.7949 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0
  8046. 2.3464 0.3831 -0.9105 H 0 0 0 0 0 0 0 0 0 0 0 0
  8047. 1.8678 -0.6084 1.3318 H 0 0 0 0 0 0 0 0 0 0 0 0
  8048. 1 2 2 0
  8049. 2 3 1 0
  8050. 3 4 2 0
  8051. 4 5 1 0
  8052. 5 6 2 0
  8053. 6 1 1 0
  8054. 1 7 1 0
  8055. 2 8 1 0
  8056. 3 9 1 0
  8057. 5 10 1 0
  8058. 6 11 1 0
  8059. M END
  8060. $$$$
  8061. RDKit 3D
  8062. 11 11 0 0 0 0 0 0 0 0999 V2000
  8063. -0.2702 -0.4724 1.0514 C 0 0 0 0 0 0 0 0 0 0 0 0
  8064. -1.2785 -0.0704 0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0
  8065. -0.9129 0.4770 -1.0378 C 0 0 0 0 0 0 0 0 0 0 0 0
  8066. 0.3682 0.6437 -1.4328 N 0 0 0 0 0 0 0 0 0 0 0 0
  8067. 1.3253 0.2441 -0.5673 C 0 0 0 0 0 0 0 0 0 0 0 0
  8068. 1.0589 -0.3136 0.6731 C 0 0 0 0 0 0 0 0 0 0 0 0
  8069. -0.5180 -0.9058 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0
  8070. -2.3238 -0.1807 0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0
  8071. -1.6631 0.8059 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0
  8072. 2.3464 0.3888 -0.9081 H 0 0 0 0 0 0 0 0 0 0 0 0
  8073. 1.8678 -0.6167 1.3279 H 0 0 0 0 0 0 0 0 0 0 0 0
  8074. 1 2 2 0
  8075. 2 3 1 0
  8076. 3 4 2 0
  8077. 4 5 1 0
  8078. 5 6 2 0
  8079. 6 1 1 0
  8080. 1 7 1 0
  8081. 2 8 1 0
  8082. 3 9 1 0
  8083. 5 10 1 0
  8084. 6 11 1 0
  8085. M END
  8086. $$$$
  8087. RDKit 3D
  8088. 11 11 0 0 0 0 0 0 0 0999 V2000
  8089. -0.2702 -0.4790 1.0484 C 0 0 0 0 0 0 0 0 0 0 0 0
  8090. -1.2785 -0.0716 0.1812 C 0 0 0 0 0 0 0 0 0 0 0 0
  8091. -0.9129 0.4835 -1.0348 C 0 0 0 0 0 0 0 0 0 0 0 0
  8092. 0.3682 0.6527 -1.4287 N 0 0 0 0 0 0 0 0 0 0 0 0
  8093. 1.3253 0.2477 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0
  8094. 1.0589 -0.3178 0.6711 C 0 0 0 0 0 0 0 0 0 0 0 0
  8095. -0.5180 -0.9184 2.0102 H 0 0 0 0 0 0 0 0 0 0 0 0
  8096. -2.3238 -0.1835 0.4456 H 0 0 0 0 0 0 0 0 0 0 0 0
  8097. -1.6631 0.8169 -1.7459 H 0 0 0 0 0 0 0 0 0 0 0 0
  8098. 2.3464 0.3945 -0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0
  8099. 1.8678 -0.6250 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0
  8100. 1 2 2 0
  8101. 2 3 1 0
  8102. 3 4 2 0
  8103. 4 5 1 0
  8104. 5 6 2 0
  8105. 6 1 1 0
  8106. 1 7 1 0
  8107. 2 8 1 0
  8108. 3 9 1 0
  8109. 5 10 1 0
  8110. 6 11 1 0
  8111. M END
  8112. $$$$
  8113. RDKit 3D
  8114. 11 11 0 0 0 0 0 0 0 0999 V2000
  8115. -0.2702 -0.4856 1.0454 C 0 0 0 0 0 0 0 0 0 0 0 0
  8116. -1.2785 -0.0727 0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0
  8117. -0.9129 0.4900 -1.0317 C 0 0 0 0 0 0 0 0 0 0 0 0
  8118. 0.3682 0.6617 -1.4246 N 0 0 0 0 0 0 0 0 0 0 0 0
  8119. 1.3253 0.2513 -0.5641 C 0 0 0 0 0 0 0 0 0 0 0 0
  8120. 1.0589 -0.3220 0.6691 C 0 0 0 0 0 0 0 0 0 0 0 0
  8121. -0.5180 -0.9310 2.0044 H 0 0 0 0 0 0 0 0 0 0 0 0
  8122. -2.3238 -0.1863 0.4445 H 0 0 0 0 0 0 0 0 0 0 0 0
  8123. -1.6631 0.8279 -1.7407 H 0 0 0 0 0 0 0 0 0 0 0 0
  8124. 2.3464 0.4002 -0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0
  8125. 1.8678 -0.6334 1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0
  8126. 1 2 2 0
  8127. 2 3 1 0
  8128. 3 4 2 0
  8129. 4 5 1 0
  8130. 5 6 2 0
  8131. 6 1 1 0
  8132. 1 7 1 0
  8133. 2 8 1 0
  8134. 3 9 1 0
  8135. 5 10 1 0
  8136. 6 11 1 0
  8137. M END
  8138. $$$$
  8139. RDKit 3D
  8140. 11 11 0 0 0 0 0 0 0 0999 V2000
  8141. -0.2702 -0.4921 1.0423 C 0 0 0 0 0 0 0 0 0 0 0 0
  8142. -1.2785 -0.0738 0.1803 C 0 0 0 0 0 0 0 0 0 0 0 0
  8143. -0.9129 0.4965 -1.0286 C 0 0 0 0 0 0 0 0 0 0 0 0
  8144. 0.3682 0.6706 -1.4204 N 0 0 0 0 0 0 0 0 0 0 0 0
  8145. 1.3253 0.2548 -0.5625 C 0 0 0 0 0 0 0 0 0 0 0 0
  8146. 1.0589 -0.3262 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0
  8147. -0.5180 -0.9436 1.9985 H 0 0 0 0 0 0 0 0 0 0 0 0
  8148. -2.3238 -0.1890 0.4433 H 0 0 0 0 0 0 0 0 0 0 0 0
  8149. -1.6631 0.8388 -1.7355 H 0 0 0 0 0 0 0 0 0 0 0 0
  8150. 2.3464 0.4058 -0.9006 H 0 0 0 0 0 0 0 0 0 0 0 0
  8151. 1.8678 -0.6416 1.3161 H 0 0 0 0 0 0 0 0 0 0 0 0
  8152. 1 2 2 0
  8153. 2 3 1 0
  8154. 3 4 2 0
  8155. 4 5 1 0
  8156. 5 6 2 0
  8157. 6 1 1 0
  8158. 1 7 1 0
  8159. 2 8 1 0
  8160. 3 9 1 0
  8161. 5 10 1 0
  8162. 6 11 1 0
  8163. M END
  8164. $$$$
  8165. RDKit 3D
  8166. 11 11 0 0 0 0 0 0 0 0999 V2000
  8167. -0.2702 -0.4987 1.0392 C 0 0 0 0 0 0 0 0 0 0 0 0
  8168. -1.2785 -0.0750 0.1798 C 0 0 0 0 0 0 0 0 0 0 0 0
  8169. -0.9129 0.5029 -1.0255 C 0 0 0 0 0 0 0 0 0 0 0 0
  8170. 0.3682 0.6795 -1.4161 N 0 0 0 0 0 0 0 0 0 0 0 0
  8171. 1.3253 0.2583 -0.5609 C 0 0 0 0 0 0 0 0 0 0 0 0
  8172. 1.0589 -0.3304 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0
  8173. -0.5180 -0.9561 1.9926 H 0 0 0 0 0 0 0 0 0 0 0 0
  8174. -2.3238 -0.1918 0.4421 H 0 0 0 0 0 0 0 0 0 0 0 0
  8175. -1.6631 0.8497 -1.7302 H 0 0 0 0 0 0 0 0 0 0 0 0
  8176. 2.3464 0.4115 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0
  8177. 1.8678 -0.6499 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8178. 1 2 2 0
  8179. 2 3 1 0
  8180. 3 4 2 0
  8181. 4 5 1 0
  8182. 5 6 2 0
  8183. 6 1 1 0
  8184. 1 7 1 0
  8185. 2 8 1 0
  8186. 3 9 1 0
  8187. 5 10 1 0
  8188. 6 11 1 0
  8189. M END
  8190. $$$$
  8191. RDKit 3D
  8192. 11 11 0 0 0 0 0 0 0 0999 V2000
  8193. -0.2702 -0.5052 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0
  8194. -1.2785 -0.0761 0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0
  8195. -0.9129 0.5094 -1.0223 C 0 0 0 0 0 0 0 0 0 0 0 0
  8196. 0.3682 0.6884 -1.4118 N 0 0 0 0 0 0 0 0 0 0 0 0
  8197. 1.3253 0.2618 -0.5593 C 0 0 0 0 0 0 0 0 0 0 0 0
  8198. 1.0589 -0.3346 0.6629 C 0 0 0 0 0 0 0 0 0 0 0 0
  8199. -0.5180 -0.9686 1.9865 H 0 0 0 0 0 0 0 0 0 0 0 0
  8200. -2.3238 -0.1946 0.4409 H 0 0 0 0 0 0 0 0 0 0 0 0
  8201. -1.6631 0.8605 -1.7248 H 0 0 0 0 0 0 0 0 0 0 0 0
  8202. 2.3464 0.4171 -0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0
  8203. 1.8678 -0.6581 1.3079 H 0 0 0 0 0 0 0 0 0 0 0 0
  8204. 1 2 2 0
  8205. 2 3 1 0
  8206. 3 4 2 0
  8207. 4 5 1 0
  8208. 5 6 2 0
  8209. 6 1 1 0
  8210. 1 7 1 0
  8211. 2 8 1 0
  8212. 3 9 1 0
  8213. 5 10 1 0
  8214. 6 11 1 0
  8215. M END
  8216. $$$$
  8217. RDKit 3D
  8218. 11 11 0 0 0 0 0 0 0 0999 V2000
  8219. -0.2702 -0.5117 1.0328 C 0 0 0 0 0 0 0 0 0 0 0 0
  8220. -1.2785 -0.0772 0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0
  8221. -0.9129 0.5158 -1.0191 C 0 0 0 0 0 0 0 0 0 0 0 0
  8222. 0.3682 0.6973 -1.4075 N 0 0 0 0 0 0 0 0 0 0 0 0
  8223. 1.3253 0.2654 -0.5576 C 0 0 0 0 0 0 0 0 0 0 0 0
  8224. 1.0589 -0.3387 0.6608 C 0 0 0 0 0 0 0 0 0 0 0 0
  8225. -0.5180 -0.9811 1.9804 H 0 0 0 0 0 0 0 0 0 0 0 0
  8226. -2.3238 -0.1974 0.4396 H 0 0 0 0 0 0 0 0 0 0 0 0
  8227. -1.6631 0.8713 -1.7194 H 0 0 0 0 0 0 0 0 0 0 0 0
  8228. 2.3464 0.4227 -0.8928 H 0 0 0 0 0 0 0 0 0 0 0 0
  8229. 1.8678 -0.6663 1.3038 H 0 0 0 0 0 0 0 0 0 0 0 0
  8230. 1 2 2 0
  8231. 2 3 1 0
  8232. 3 4 2 0
  8233. 4 5 1 0
  8234. 5 6 2 0
  8235. 6 1 1 0
  8236. 1 7 1 0
  8237. 2 8 1 0
  8238. 3 9 1 0
  8239. 5 10 1 0
  8240. 6 11 1 0
  8241. M END
  8242. $$$$
  8243. RDKit 3D
  8244. 11 11 0 0 0 0 0 0 0 0999 V2000
  8245. -0.2702 -0.5182 1.0296 C 0 0 0 0 0 0 0 0 0 0 0 0
  8246. -1.2785 -0.0784 0.1784 C 0 0 0 0 0 0 0 0 0 0 0 0
  8247. -0.9129 0.5222 -1.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
  8248. 0.3682 0.7061 -1.4031 N 0 0 0 0 0 0 0 0 0 0 0 0
  8249. 1.3253 0.2688 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0
  8250. 1.0589 -0.3429 0.6586 C 0 0 0 0 0 0 0 0 0 0 0 0
  8251. -0.5180 -0.9935 1.9742 H 0 0 0 0 0 0 0 0 0 0 0 0
  8252. -2.3238 -0.2001 0.4384 H 0 0 0 0 0 0 0 0 0 0 0 0
  8253. -1.6631 0.8821 -1.7138 H 0 0 0 0 0 0 0 0 0 0 0 0
  8254. 2.3464 0.4283 -0.8901 H 0 0 0 0 0 0 0 0 0 0 0 0
  8255. 1.8678 -0.6745 1.2995 H 0 0 0 0 0 0 0 0 0 0 0 0
  8256. 1 2 2 0
  8257. 2 3 1 0
  8258. 3 4 2 0
  8259. 4 5 1 0
  8260. 5 6 2 0
  8261. 6 1 1 0
  8262. 1 7 1 0
  8263. 2 8 1 0
  8264. 3 9 1 0
  8265. 5 10 1 0
  8266. 6 11 1 0
  8267. M END
  8268. $$$$
  8269. RDKit 3D
  8270. 11 11 0 0 0 0 0 0 0 0999 V2000
  8271. -0.2702 -0.5246 1.0263 C 0 0 0 0 0 0 0 0 0 0 0 0
  8272. -1.2785 -0.0795 0.1779 C 0 0 0 0 0 0 0 0 0 0 0 0
  8273. -0.9129 0.5285 -1.0125 C 0 0 0 0 0 0 0 0 0 0 0 0
  8274. 0.3682 0.7149 -1.3986 N 0 0 0 0 0 0 0 0 0 0 0 0
  8275. 1.3253 0.2723 -0.5543 C 0 0 0 0 0 0 0 0 0 0 0 0
  8276. 1.0589 -0.3470 0.6565 C 0 0 0 0 0 0 0 0 0 0 0 0
  8277. -0.5180 -1.0059 1.9679 H 0 0 0 0 0 0 0 0 0 0 0 0
  8278. -2.3238 -0.2029 0.4371 H 0 0 0 0 0 0 0 0 0 0 0 0
  8279. -1.6631 0.8929 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0
  8280. 2.3464 0.4339 -0.8874 H 0 0 0 0 0 0 0 0 0 0 0 0
  8281. 1.8678 -0.6827 1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0
  8282. 1 2 2 0
  8283. 2 3 1 0
  8284. 3 4 2 0
  8285. 4 5 1 0
  8286. 5 6 2 0
  8287. 6 1 1 0
  8288. 1 7 1 0
  8289. 2 8 1 0
  8290. 3 9 1 0
  8291. 5 10 1 0
  8292. 6 11 1 0
  8293. M END
  8294. $$$$
  8295. RDKit 3D
  8296. 11 11 0 0 0 0 0 0 0 0999 V2000
  8297. -0.2702 -0.5311 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  8298. -1.2785 -0.0806 0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0
  8299. -0.9129 0.5349 -1.0092 C 0 0 0 0 0 0 0 0 0 0 0 0
  8300. 0.3682 0.7237 -1.3941 N 0 0 0 0 0 0 0 0 0 0 0 0
  8301. 1.3253 0.2758 -0.5525 C 0 0 0 0 0 0 0 0 0 0 0 0
  8302. 1.0589 -0.3511 0.6543 C 0 0 0 0 0 0 0 0 0 0 0 0
  8303. -0.5180 -1.0183 1.9616 H 0 0 0 0 0 0 0 0 0 0 0 0
  8304. -2.3238 -0.2056 0.4358 H 0 0 0 0 0 0 0 0 0 0 0 0
  8305. -1.6631 0.9036 -1.7026 H 0 0 0 0 0 0 0 0 0 0 0 0
  8306. 2.3464 0.4395 -0.8846 H 0 0 0 0 0 0 0 0 0 0 0 0
  8307. 1.8678 -0.6908 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0
  8308. 1 2 2 0
  8309. 2 3 1 0
  8310. 3 4 2 0
  8311. 4 5 1 0
  8312. 5 6 2 0
  8313. 6 1 1 0
  8314. 1 7 1 0
  8315. 2 8 1 0
  8316. 3 9 1 0
  8317. 5 10 1 0
  8318. 6 11 1 0
  8319. M END
  8320. $$$$
  8321. RDKit 3D
  8322. 11 11 0 0 0 0 0 0 0 0999 V2000
  8323. -0.2702 -0.5375 1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0
  8324. -1.2785 -0.0817 0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0
  8325. -0.9129 0.5412 -1.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
  8326. 0.3682 0.7324 -1.3895 N 0 0 0 0 0 0 0 0 0 0 0 0
  8327. 1.3253 0.2793 -0.5508 C 0 0 0 0 0 0 0 0 0 0 0 0
  8328. 1.0589 -0.3552 0.6521 C 0 0 0 0 0 0 0 0 0 0 0 0
  8329. -0.5180 -1.0306 1.9551 H 0 0 0 0 0 0 0 0 0 0 0 0
  8330. -2.3238 -0.2084 0.4345 H 0 0 0 0 0 0 0 0 0 0 0 0
  8331. -1.6631 0.9143 -1.6969 H 0 0 0 0 0 0 0 0 0 0 0 0
  8332. 2.3464 0.4450 -0.8819 H 0 0 0 0 0 0 0 0 0 0 0 0
  8333. 1.8678 -0.6989 1.2866 H 0 0 0 0 0 0 0 0 0 0 0 0
  8334. 1 2 2 0
  8335. 2 3 1 0
  8336. 3 4 2 0
  8337. 4 5 1 0
  8338. 5 6 2 0
  8339. 6 1 1 0
  8340. 1 7 1 0
  8341. 2 8 1 0
  8342. 3 9 1 0
  8343. 5 10 1 0
  8344. 6 11 1 0
  8345. M END
  8346. $$$$
  8347. RDKit 3D
  8348. 11 11 0 0 0 0 0 0 0 0999 V2000
  8349. -0.2702 -0.5439 1.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
  8350. -1.2785 -0.0828 0.1764 C 0 0 0 0 0 0 0 0 0 0 0 0
  8351. -0.9129 0.5475 -1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0
  8352. 0.3682 0.7411 -1.3849 N 0 0 0 0 0 0 0 0 0 0 0 0
  8353. 1.3253 0.2827 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0
  8354. 1.0589 -0.3593 0.6498 C 0 0 0 0 0 0 0 0 0 0 0 0
  8355. -0.5180 -1.0428 1.9486 H 0 0 0 0 0 0 0 0 0 0 0 0
  8356. -2.3238 -0.2111 0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
  8357. -1.6631 0.9249 -1.6911 H 0 0 0 0 0 0 0 0 0 0 0 0
  8358. 2.3464 0.4506 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  8359. 1.8678 -0.7069 1.2822 H 0 0 0 0 0 0 0 0 0 0 0 0
  8360. 1 2 2 0
  8361. 2 3 1 0
  8362. 3 4 2 0
  8363. 4 5 1 0
  8364. 5 6 2 0
  8365. 6 1 1 0
  8366. 1 7 1 0
  8367. 2 8 1 0
  8368. 3 9 1 0
  8369. 5 10 1 0
  8370. 6 11 1 0
  8371. M END
  8372. $$$$
  8373. RDKit 3D
  8374. 11 11 0 0 0 0 0 0 0 0999 V2000
  8375. -0.2702 -0.5502 1.0128 C 0 0 0 0 0 0 0 0 0 0 0 0
  8376. -1.2785 -0.0839 0.1759 C 0 0 0 0 0 0 0 0 0 0 0 0
  8377. -0.9129 0.5538 -0.9989 C 0 0 0 0 0 0 0 0 0 0 0 0
  8378. 0.3682 0.7498 -1.3802 N 0 0 0 0 0 0 0 0 0 0 0 0
  8379. 1.3253 0.2862 -0.5472 C 0 0 0 0 0 0 0 0 0 0 0 0
  8380. 1.0589 -0.3634 0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0
  8381. -0.5180 -1.0551 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0
  8382. -2.3238 -0.2138 0.4319 H 0 0 0 0 0 0 0 0 0 0 0 0
  8383. -1.6631 0.9355 -1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0
  8384. 2.3464 0.4561 -0.8762 H 0 0 0 0 0 0 0 0 0 0 0 0
  8385. 1.8678 -0.7150 1.2777 H 0 0 0 0 0 0 0 0 0 0 0 0
  8386. 1 2 2 0
  8387. 2 3 1 0
  8388. 3 4 2 0
  8389. 4 5 1 0
  8390. 5 6 2 0
  8391. 6 1 1 0
  8392. 1 7 1 0
  8393. 2 8 1 0
  8394. 3 9 1 0
  8395. 5 10 1 0
  8396. 6 11 1 0
  8397. M END
  8398. $$$$
  8399. RDKit 3D
  8400. 11 11 0 0 0 0 0 0 0 0999 V2000
  8401. -0.2702 -0.5566 1.0093 C 0 0 0 0 0 0 0 0 0 0 0 0
  8402. -1.2785 -0.0850 0.1753 C 0 0 0 0 0 0 0 0 0 0 0 0
  8403. -0.9129 0.5601 -0.9954 C 0 0 0 0 0 0 0 0 0 0 0 0
  8404. 0.3682 0.7585 -1.3755 N 0 0 0 0 0 0 0 0 0 0 0 0
  8405. 1.3253 0.2896 -0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0
  8406. 1.0589 -0.3675 0.6452 C 0 0 0 0 0 0 0 0 0 0 0 0
  8407. -0.5180 -1.0672 1.9353 H 0 0 0 0 0 0 0 0 0 0 0 0
  8408. -2.3238 -0.2165 0.4305 H 0 0 0 0 0 0 0 0 0 0 0 0
  8409. -1.6631 0.9461 -1.6794 H 0 0 0 0 0 0 0 0 0 0 0 0
  8410. 2.3464 0.4616 -0.8733 H 0 0 0 0 0 0 0 0 0 0 0 0
  8411. 1.8678 -0.7230 1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0
  8412. 1 2 2 0
  8413. 2 3 1 0
  8414. 3 4 2 0
  8415. 4 5 1 0
  8416. 5 6 2 0
  8417. 6 1 1 0
  8418. 1 7 1 0
  8419. 2 8 1 0
  8420. 3 9 1 0
  8421. 5 10 1 0
  8422. 6 11 1 0
  8423. M END
  8424. $$$$
  8425. RDKit 3D
  8426. 11 11 0 0 0 0 0 0 0 0999 V2000
  8427. -0.2702 -0.5629 1.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
  8428. -1.2785 -0.0861 0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0
  8429. -0.9129 0.5663 -0.9919 C 0 0 0 0 0 0 0 0 0 0 0 0
  8430. 0.3682 0.7671 -1.3707 N 0 0 0 0 0 0 0 0 0 0 0 0
  8431. 1.3253 0.2930 -0.5436 C 0 0 0 0 0 0 0 0 0 0 0 0
  8432. 1.0589 -0.3715 0.6429 C 0 0 0 0 0 0 0 0 0 0 0 0
  8433. -0.5180 -1.0794 1.9286 H 0 0 0 0 0 0 0 0 0 0 0 0
  8434. -2.3238 -0.2192 0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0
  8435. -1.6631 0.9566 -1.6734 H 0 0 0 0 0 0 0 0 0 0 0 0
  8436. 2.3464 0.4671 -0.8704 H 0 0 0 0 0 0 0 0 0 0 0 0
  8437. 1.8678 -0.7310 1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0
  8438. 1 2 2 0
  8439. 2 3 1 0
  8440. 3 4 2 0
  8441. 4 5 1 0
  8442. 5 6 2 0
  8443. 6 1 1 0
  8444. 1 7 1 0
  8445. 2 8 1 0
  8446. 3 9 1 0
  8447. 5 10 1 0
  8448. 6 11 1 0
  8449. M END
  8450. $$$$
  8451. RDKit 3D
  8452. 11 11 0 0 0 0 0 0 0 0999 V2000
  8453. -0.2702 -0.5692 1.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
  8454. -1.2785 -0.0872 0.1742 C 0 0 0 0 0 0 0 0 0 0 0 0
  8455. -0.9129 0.5725 -0.9883 C 0 0 0 0 0 0 0 0 0 0 0 0
  8456. 0.3682 0.7757 -1.3658 N 0 0 0 0 0 0 0 0 0 0 0 0
  8457. 1.3253 0.2964 -0.5418 C 0 0 0 0 0 0 0 0 0 0 0 0
  8458. 1.0589 -0.3756 0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0
  8459. -0.5180 -1.0915 1.9218 H 0 0 0 0 0 0 0 0 0 0 0 0
  8460. -2.3238 -0.2219 0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0
  8461. -1.6631 0.9671 -1.6674 H 0 0 0 0 0 0 0 0 0 0 0 0
  8462. 2.3464 0.4725 -0.8674 H 0 0 0 0 0 0 0 0 0 0 0 0
  8463. 1.8678 -0.7389 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  8464. 1 2 2 0
  8465. 2 3 1 0
  8466. 3 4 2 0
  8467. 4 5 1 0
  8468. 5 6 2 0
  8469. 6 1 1 0
  8470. 1 7 1 0
  8471. 2 8 1 0
  8472. 3 9 1 0
  8473. 5 10 1 0
  8474. 6 11 1 0
  8475. M END
  8476. $$$$
  8477. RDKit 3D
  8478. 11 11 0 0 0 0 0 0 0 0999 V2000
  8479. -0.2702 -0.5755 0.9987 C 0 0 0 0 0 0 0 0 0 0 0 0
  8480. -1.2785 -0.0883 0.1737 C 0 0 0 0 0 0 0 0 0 0 0 0
  8481. -0.9129 0.5787 -0.9847 C 0 0 0 0 0 0 0 0 0 0 0 0
  8482. 0.3682 0.7843 -1.3609 N 0 0 0 0 0 0 0 0 0 0 0 0
  8483. 1.3253 0.2998 -0.5399 C 0 0 0 0 0 0 0 0 0 0 0 0
  8484. 1.0589 -0.3796 0.6382 C 0 0 0 0 0 0 0 0 0 0 0 0
  8485. -0.5180 -1.1035 1.9149 H 0 0 0 0 0 0 0 0 0 0 0 0
  8486. -2.3238 -0.2246 0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0
  8487. -1.6631 0.9776 -1.6613 H 0 0 0 0 0 0 0 0 0 0 0 0
  8488. 2.3464 0.4780 -0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0
  8489. 1.8678 -0.7469 1.2593 H 0 0 0 0 0 0 0 0 0 0 0 0
  8490. 1 2 2 0
  8491. 2 3 1 0
  8492. 3 4 2 0
  8493. 4 5 1 0
  8494. 5 6 2 0
  8495. 6 1 1 0
  8496. 1 7 1 0
  8497. 2 8 1 0
  8498. 3 9 1 0
  8499. 5 10 1 0
  8500. 6 11 1 0
  8501. M END
  8502. $$$$
  8503. RDKit 3D
  8504. 11 11 0 0 0 0 0 0 0 0999 V2000
  8505. -0.2702 -0.5818 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0
  8506. -1.2785 -0.0894 0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0
  8507. -0.9129 0.5849 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0
  8508. 0.3682 0.7928 -1.3560 N 0 0 0 0 0 0 0 0 0 0 0 0
  8509. 1.3253 0.3032 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0
  8510. 1.0589 -0.3836 0.6358 C 0 0 0 0 0 0 0 0 0 0 0 0
  8511. -0.5180 -1.1155 1.9079 H 0 0 0 0 0 0 0 0 0 0 0 0
  8512. -2.3238 -0.2273 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0
  8513. -1.6631 0.9880 -1.6551 H 0 0 0 0 0 0 0 0 0 0 0 0
  8514. 2.3464 0.4834 -0.8614 H 0 0 0 0 0 0 0 0 0 0 0 0
  8515. 1.8678 -0.7548 1.2546 H 0 0 0 0 0 0 0 0 0 0 0 0
  8516. 1 2 2 0
  8517. 2 3 1 0
  8518. 3 4 2 0
  8519. 4 5 1 0
  8520. 5 6 2 0
  8521. 6 1 1 0
  8522. 1 7 1 0
  8523. 2 8 1 0
  8524. 3 9 1 0
  8525. 5 10 1 0
  8526. 6 11 1 0
  8527. M END
  8528. $$$$
  8529. RDKit 3D
  8530. 11 11 0 0 0 0 0 0 0 0999 V2000
  8531. -0.2702 -0.5880 0.9914 C 0 0 0 0 0 0 0 0 0 0 0 0
  8532. -1.2785 -0.0905 0.1726 C 0 0 0 0 0 0 0 0 0 0 0 0
  8533. -0.9129 0.5911 -0.9773 C 0 0 0 0 0 0 0 0 0 0 0 0
  8534. 0.3682 0.8013 -1.3510 N 0 0 0 0 0 0 0 0 0 0 0 0
  8535. 1.3253 0.3066 -0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0
  8536. 1.0589 -0.3876 0.6334 C 0 0 0 0 0 0 0 0 0 0 0 0
  8537. -0.5180 -1.1275 1.9009 H 0 0 0 0 0 0 0 0 0 0 0 0
  8538. -2.3238 -0.2299 0.4235 H 0 0 0 0 0 0 0 0 0 0 0 0
  8539. -1.6631 0.9984 -1.6488 H 0 0 0 0 0 0 0 0 0 0 0 0
  8540. 2.3464 0.4888 -0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0
  8541. 1.8678 -0.7626 1.2499 H 0 0 0 0 0 0 0 0 0 0 0 0
  8542. 1 2 2 0
  8543. 2 3 1 0
  8544. 3 4 2 0
  8545. 4 5 1 0
  8546. 5 6 2 0
  8547. 6 1 1 0
  8548. 1 7 1 0
  8549. 2 8 1 0
  8550. 3 9 1 0
  8551. 5 10 1 0
  8552. 6 11 1 0
  8553. M END
  8554. $$$$
  8555. RDKit 3D
  8556. 11 11 0 0 0 0 0 0 0 0999 V2000
  8557. -0.2702 -0.5942 0.9876 C 0 0 0 0 0 0 0 0 0 0 0 0
  8558. -1.2785 -0.0916 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0
  8559. -0.9129 0.5972 -0.9736 C 0 0 0 0 0 0 0 0 0 0 0 0
  8560. 0.3682 0.8098 -1.3459 N 0 0 0 0 0 0 0 0 0 0 0 0
  8561. 1.3253 0.3100 -0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0
  8562. 1.0589 -0.3915 0.6309 C 0 0 0 0 0 0 0 0 0 0 0 0
  8563. -0.5180 -1.1394 1.8938 H 0 0 0 0 0 0 0 0 0 0 0 0
  8564. -2.3238 -0.2326 0.4221 H 0 0 0 0 0 0 0 0 0 0 0 0
  8565. -1.6631 1.0087 -1.6425 H 0 0 0 0 0 0 0 0 0 0 0 0
  8566. 2.3464 0.4942 -0.8553 H 0 0 0 0 0 0 0 0 0 0 0 0
  8567. 1.8678 -0.7705 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
  8568. 1 2 2 0
  8569. 2 3 1 0
  8570. 3 4 2 0
  8571. 4 5 1 0
  8572. 5 6 2 0
  8573. 6 1 1 0
  8574. 1 7 1 0
  8575. 2 8 1 0
  8576. 3 9 1 0
  8577. 5 10 1 0
  8578. 6 11 1 0
  8579. M END
  8580. $$$$
  8581. RDKit 3D
  8582. 11 11 0 0 0 0 0 0 0 0999 V2000
  8583. -0.2702 -0.6004 0.9839 C 0 0 0 0 0 0 0 0 0 0 0 0
  8584. -1.2785 -0.0927 0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0
  8585. -0.9129 0.6033 -0.9698 C 0 0 0 0 0 0 0 0 0 0 0 0
  8586. 0.3682 0.8182 -1.3408 N 0 0 0 0 0 0 0 0 0 0 0 0
  8587. 1.3253 0.3133 -0.5322 C 0 0 0 0 0 0 0 0 0 0 0 0
  8588. 1.0589 -0.3955 0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0
  8589. -0.5180 -1.1513 1.8866 H 0 0 0 0 0 0 0 0 0 0 0 0
  8590. -2.3238 -0.2352 0.4206 H 0 0 0 0 0 0 0 0 0 0 0 0
  8591. -1.6631 1.0190 -1.6362 H 0 0 0 0 0 0 0 0 0 0 0 0
  8592. 2.3464 0.4995 -0.8522 H 0 0 0 0 0 0 0 0 0 0 0 0
  8593. 1.8678 -0.7783 1.2402 H 0 0 0 0 0 0 0 0 0 0 0 0
  8594. 1 2 2 0
  8595. 2 3 1 0
  8596. 3 4 2 0
  8597. 4 5 1 0
  8598. 5 6 2 0
  8599. 6 1 1 0
  8600. 1 7 1 0
  8601. 2 8 1 0
  8602. 3 9 1 0
  8603. 5 10 1 0
  8604. 6 11 1 0
  8605. M END
  8606. $$$$
  8607. RDKit 3D
  8608. 11 11 0 0 0 0 0 0 0 0999 V2000
  8609. -0.2702 -0.6066 0.9801 C 0 0 0 0 0 0 0 0 0 0 0 0
  8610. -1.2785 -0.0937 0.1708 C 0 0 0 0 0 0 0 0 0 0 0 0
  8611. -0.9129 0.6094 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0
  8612. 0.3682 0.8266 -1.3356 N 0 0 0 0 0 0 0 0 0 0 0 0
  8613. 1.3253 0.3167 -0.5302 C 0 0 0 0 0 0 0 0 0 0 0 0
  8614. 1.0589 -0.3994 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0
  8615. -0.5180 -1.1631 1.8793 H 0 0 0 0 0 0 0 0 0 0 0 0
  8616. -2.3238 -0.2379 0.4191 H 0 0 0 0 0 0 0 0 0 0 0 0
  8617. -1.6631 1.0293 -1.6297 H 0 0 0 0 0 0 0 0 0 0 0 0
  8618. 2.3464 0.5049 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0
  8619. 1.8678 -0.7861 1.2353 H 0 0 0 0 0 0 0 0 0 0 0 0
  8620. 1 2 2 0
  8621. 2 3 1 0
  8622. 3 4 2 0
  8623. 4 5 1 0
  8624. 5 6 2 0
  8625. 6 1 1 0
  8626. 1 7 1 0
  8627. 2 8 1 0
  8628. 3 9 1 0
  8629. 5 10 1 0
  8630. 6 11 1 0
  8631. M END
  8632. $$$$
  8633. RDKit 3D
  8634. 11 11 0 0 0 0 0 0 0 0999 V2000
  8635. -0.2702 -0.6128 0.9763 C 0 0 0 0 0 0 0 0 0 0 0 0
  8636. -1.2785 -0.0948 0.1702 C 0 0 0 0 0 0 0 0 0 0 0 0
  8637. -0.9129 0.6154 -0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0
  8638. 0.3682 0.8350 -1.3304 N 0 0 0 0 0 0 0 0 0 0 0 0
  8639. 1.3253 0.3200 -0.5282 C 0 0 0 0 0 0 0 0 0 0 0 0
  8640. 1.0589 -0.4034 0.6234 C 0 0 0 0 0 0 0 0 0 0 0 0
  8641. -0.5180 -1.1749 1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0
  8642. -2.3238 -0.2405 0.4176 H 0 0 0 0 0 0 0 0 0 0 0 0
  8643. -1.6631 1.0395 -1.6232 H 0 0 0 0 0 0 0 0 0 0 0 0
  8644. 2.3464 0.5102 -0.8458 H 0 0 0 0 0 0 0 0 0 0 0 0
  8645. 1.8678 -0.7938 1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0
  8646. 1 2 2 0
  8647. 2 3 1 0
  8648. 3 4 2 0
  8649. 4 5 1 0
  8650. 5 6 2 0
  8651. 6 1 1 0
  8652. 1 7 1 0
  8653. 2 8 1 0
  8654. 3 9 1 0
  8655. 5 10 1 0
  8656. 6 11 1 0
  8657. M END
  8658. $$$$
  8659. RDKit 3D
  8660. 11 11 0 0 0 0 0 0 0 0999 V2000
  8661. -0.2702 -0.6189 0.9724 C 0 0 0 0 0 0 0 0 0 0 0 0
  8662. -1.2785 -0.0959 0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0
  8663. -0.9129 0.6215 -0.9583 C 0 0 0 0 0 0 0 0 0 0 0 0
  8664. 0.3682 0.8434 -1.3251 N 0 0 0 0 0 0 0 0 0 0 0 0
  8665. 1.3253 0.3233 -0.5262 C 0 0 0 0 0 0 0 0 0 0 0 0
  8666. 1.0589 -0.4073 0.6209 C 0 0 0 0 0 0 0 0 0 0 0 0
  8667. -0.5180 -1.1867 1.8645 H 0 0 0 0 0 0 0 0 0 0 0 0
  8668. -2.3238 -0.2431 0.4161 H 0 0 0 0 0 0 0 0 0 0 0 0
  8669. -1.6631 1.0497 -1.6167 H 0 0 0 0 0 0 0 0 0 0 0 0
  8670. 2.3464 0.5155 -0.8426 H 0 0 0 0 0 0 0 0 0 0 0 0
  8671. 1.8678 -0.8015 1.2253 H 0 0 0 0 0 0 0 0 0 0 0 0
  8672. 1 2 2 0
  8673. 2 3 1 0
  8674. 3 4 2 0
  8675. 4 5 1 0
  8676. 5 6 2 0
  8677. 6 1 1 0
  8678. 1 7 1 0
  8679. 2 8 1 0
  8680. 3 9 1 0
  8681. 5 10 1 0
  8682. 6 11 1 0
  8683. M END
  8684. $$$$
  8685. RDKit 3D
  8686. 11 11 0 0 0 0 0 0 0 0999 V2000
  8687. -0.2702 -0.6250 0.9685 C 0 0 0 0 0 0 0 0 0 0 0 0
  8688. -1.2785 -0.0969 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0
  8689. -0.9129 0.6275 -0.9543 C 0 0 0 0 0 0 0 0 0 0 0 0
  8690. 0.3682 0.8517 -1.3198 N 0 0 0 0 0 0 0 0 0 0 0 0
  8691. 1.3253 0.3266 -0.5241 C 0 0 0 0 0 0 0 0 0 0 0 0
  8692. 1.0589 -0.4112 0.6183 C 0 0 0 0 0 0 0 0 0 0 0 0
  8693. -0.5180 -1.1983 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0
  8694. -2.3238 -0.2457 0.4145 H 0 0 0 0 0 0 0 0 0 0 0 0
  8695. -1.6631 1.0598 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0
  8696. 2.3464 0.5208 -0.8393 H 0 0 0 0 0 0 0 0 0 0 0 0
  8697. 1.8678 -0.8092 1.2202 H 0 0 0 0 0 0 0 0 0 0 0 0
  8698. 1 2 2 0
  8699. 2 3 1 0
  8700. 3 4 2 0
  8701. 4 5 1 0
  8702. 5 6 2 0
  8703. 6 1 1 0
  8704. 1 7 1 0
  8705. 2 8 1 0
  8706. 3 9 1 0
  8707. 5 10 1 0
  8708. 6 11 1 0
  8709. M END
  8710. $$$$
  8711. RDKit 3D
  8712. 11 11 0 0 0 0 0 0 0 0999 V2000
  8713. -0.2702 -0.6310 0.9646 C 0 0 0 0 0 0 0 0 0 0 0 0
  8714. -1.2785 -0.0980 0.1684 C 0 0 0 0 0 0 0 0 0 0 0 0
  8715. -0.9129 0.6335 -0.9504 C 0 0 0 0 0 0 0 0 0 0 0 0
  8716. 0.3682 0.8599 -1.3144 N 0 0 0 0 0 0 0 0 0 0 0 0
  8717. 1.3253 0.3299 -0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0
  8718. 1.0589 -0.4150 0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0
  8719. -0.5180 -1.2100 1.8495 H 0 0 0 0 0 0 0 0 0 0 0 0
  8720. -2.3238 -0.2483 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  8721. -1.6631 1.0699 -1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0
  8722. 2.3464 0.5260 -0.8361 H 0 0 0 0 0 0 0 0 0 0 0 0
  8723. 1.8678 -0.8169 1.2151 H 0 0 0 0 0 0 0 0 0 0 0 0
  8724. 1 2 2 0
  8725. 2 3 1 0
  8726. 3 4 2 0
  8727. 4 5 1 0
  8728. 5 6 2 0
  8729. 6 1 1 0
  8730. 1 7 1 0
  8731. 2 8 1 0
  8732. 3 9 1 0
  8733. 5 10 1 0
  8734. 6 11 1 0
  8735. M END
  8736. $$$$
  8737. RDKit 3D
  8738. 11 11 0 0 0 0 0 0 0 0999 V2000
  8739. -0.2702 -0.6371 0.9606 C 0 0 0 0 0 0 0 0 0 0 0 0
  8740. -1.2785 -0.0990 0.1678 C 0 0 0 0 0 0 0 0 0 0 0 0
  8741. -0.9129 0.6394 -0.9464 C 0 0 0 0 0 0 0 0 0 0 0 0
  8742. 0.3682 0.8682 -1.3090 N 0 0 0 0 0 0 0 0 0 0 0 0
  8743. 1.3253 0.3331 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0
  8744. 1.0589 -0.4189 0.6131 C 0 0 0 0 0 0 0 0 0 0 0 0
  8745. -0.5180 -1.2216 1.8418 H 0 0 0 0 0 0 0 0 0 0 0 0
  8746. -2.3238 -0.2509 0.4114 H 0 0 0 0 0 0 0 0 0 0 0 0
  8747. -1.6631 1.0800 -1.5966 H 0 0 0 0 0 0 0 0 0 0 0 0
  8748. 2.3464 0.5313 -0.8327 H 0 0 0 0 0 0 0 0 0 0 0 0
  8749. 1.8678 -0.8245 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  8750. 1 2 2 0
  8751. 2 3 1 0
  8752. 3 4 2 0
  8753. 4 5 1 0
  8754. 5 6 2 0
  8755. 6 1 1 0
  8756. 1 7 1 0
  8757. 2 8 1 0
  8758. 3 9 1 0
  8759. 5 10 1 0
  8760. 6 11 1 0
  8761. M END
  8762. $$$$
  8763. RDKit 3D
  8764. 11 11 0 0 0 0 0 0 0 0999 V2000
  8765. -0.2702 -0.6431 0.9565 C 0 0 0 0 0 0 0 0 0 0 0 0
  8766. -1.2785 -0.1001 0.1672 C 0 0 0 0 0 0 0 0 0 0 0 0
  8767. -0.9129 0.6454 -0.9424 C 0 0 0 0 0 0 0 0 0 0 0 0
  8768. 0.3682 0.8764 -1.3035 N 0 0 0 0 0 0 0 0 0 0 0 0
  8769. 1.3253 0.3364 -0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0
  8770. 1.0589 -0.4227 0.6105 C 0 0 0 0 0 0 0 0 0 0 0 0
  8771. -0.5180 -1.2331 1.8341 H 0 0 0 0 0 0 0 0 0 0 0 0
  8772. -2.3238 -0.2535 0.4098 H 0 0 0 0 0 0 0 0 0 0 0 0
  8773. -1.6631 1.0900 -1.5898 H 0 0 0 0 0 0 0 0 0 0 0 0
  8774. 2.3464 0.5365 -0.8294 H 0 0 0 0 0 0 0 0 0 0 0 0
  8775. 1.8678 -0.8321 1.2048 H 0 0 0 0 0 0 0 0 0 0 0 0
  8776. 1 2 2 0
  8777. 2 3 1 0
  8778. 3 4 2 0
  8779. 4 5 1 0
  8780. 5 6 2 0
  8781. 6 1 1 0
  8782. 1 7 1 0
  8783. 2 8 1 0
  8784. 3 9 1 0
  8785. 5 10 1 0
  8786. 6 11 1 0
  8787. M END
  8788. $$$$
  8789. RDKit 3D
  8790. 11 11 0 0 0 0 0 0 0 0999 V2000
  8791. -0.2702 -0.6491 0.9525 C 0 0 0 0 0 0 0 0 0 0 0 0
  8792. -1.2785 -0.1011 0.1665 C 0 0 0 0 0 0 0 0 0 0 0 0
  8793. -0.9129 0.6513 -0.9383 C 0 0 0 0 0 0 0 0 0 0 0 0
  8794. 0.3682 0.8846 -1.2980 N 0 0 0 0 0 0 0 0 0 0 0 0
  8795. 1.3253 0.3397 -0.5158 C 0 0 0 0 0 0 0 0 0 0 0 0
  8796. 1.0589 -0.4266 0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0
  8797. -0.5180 -1.2446 1.8263 H 0 0 0 0 0 0 0 0 0 0 0 0
  8798. -2.3238 -0.2561 0.4082 H 0 0 0 0 0 0 0 0 0 0 0 0
  8799. -1.6631 1.0999 -1.5829 H 0 0 0 0 0 0 0 0 0 0 0 0
  8800. 2.3464 0.5417 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0
  8801. 1.8678 -0.8396 1.1995 H 0 0 0 0 0 0 0 0 0 0 0 0
  8802. 1 2 2 0
  8803. 2 3 1 0
  8804. 3 4 2 0
  8805. 4 5 1 0
  8806. 5 6 2 0
  8807. 6 1 1 0
  8808. 1 7 1 0
  8809. 2 8 1 0
  8810. 3 9 1 0
  8811. 5 10 1 0
  8812. 6 11 1 0
  8813. M END
  8814. $$$$
  8815. RDKit 3D
  8816. 11 11 0 0 0 0 0 0 0 0999 V2000
  8817. -0.2702 -0.6551 0.9484 C 0 0 0 0 0 0 0 0 0 0 0 0
  8818. -1.2785 -0.1022 0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0
  8819. -0.9129 0.6571 -0.9342 C 0 0 0 0 0 0 0 0 0 0 0 0
  8820. 0.3682 0.8927 -1.2924 N 0 0 0 0 0 0 0 0 0 0 0 0
  8821. 1.3253 0.3429 -0.5136 C 0 0 0 0 0 0 0 0 0 0 0 0
  8822. 1.0589 -0.4304 0.6051 C 0 0 0 0 0 0 0 0 0 0 0 0
  8823. -0.5180 -1.2561 1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0
  8824. -2.3238 -0.2586 0.4066 H 0 0 0 0 0 0 0 0 0 0 0 0
  8825. -1.6631 1.1099 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0
  8826. 2.3464 0.5469 -0.8226 H 0 0 0 0 0 0 0 0 0 0 0 0
  8827. 1.8678 -0.8471 1.1942 H 0 0 0 0 0 0 0 0 0 0 0 0
  8828. 1 2 2 0
  8829. 2 3 1 0
  8830. 3 4 2 0
  8831. 4 5 1 0
  8832. 5 6 2 0
  8833. 6 1 1 0
  8834. 1 7 1 0
  8835. 2 8 1 0
  8836. 3 9 1 0
  8837. 5 10 1 0
  8838. 6 11 1 0
  8839. M END
  8840. $$$$
  8841. RDKit 3D
  8842. 11 11 0 0 0 0 0 0 0 0999 V2000
  8843. -0.2702 -0.6610 0.9443 C 0 0 0 0 0 0 0 0 0 0 0 0
  8844. -1.2785 -0.1032 0.1653 C 0 0 0 0 0 0 0 0 0 0 0 0
  8845. -0.9129 0.6630 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0
  8846. 0.3682 0.9008 -1.2868 N 0 0 0 0 0 0 0 0 0 0 0 0
  8847. 1.3253 0.3461 -0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0
  8848. 1.0589 -0.4342 0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0
  8849. -0.5180 -1.2675 1.8105 H 0 0 0 0 0 0 0 0 0 0 0 0
  8850. -2.3238 -0.2612 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  8851. -1.6631 1.1197 -1.5689 H 0 0 0 0 0 0 0 0 0 0 0 0
  8852. 2.3464 0.5521 -0.8191 H 0 0 0 0 0 0 0 0 0 0 0 0
  8853. 1.8678 -0.8546 1.1889 H 0 0 0 0 0 0 0 0 0 0 0 0
  8854. 1 2 2 0
  8855. 2 3 1 0
  8856. 3 4 2 0
  8857. 4 5 1 0
  8858. 5 6 2 0
  8859. 6 1 1 0
  8860. 1 7 1 0
  8861. 2 8 1 0
  8862. 3 9 1 0
  8863. 5 10 1 0
  8864. 6 11 1 0
  8865. M END
  8866. $$$$
  8867. RDKit 3D
  8868. 11 11 0 0 0 0 0 0 0 0999 V2000
  8869. -0.2702 -0.6670 0.9401 C 0 0 0 0 0 0 0 0 0 0 0 0
  8870. -1.2785 -0.1043 0.1646 C 0 0 0 0 0 0 0 0 0 0 0 0
  8871. -0.9129 0.6688 -0.9258 C 0 0 0 0 0 0 0 0 0 0 0 0
  8872. 0.3682 0.9089 -1.2811 N 0 0 0 0 0 0 0 0 0 0 0 0
  8873. 1.3253 0.3493 -0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0
  8874. 1.0589 -0.4379 0.5996 C 0 0 0 0 0 0 0 0 0 0 0 0
  8875. -0.5180 -1.2788 1.8025 H 0 0 0 0 0 0 0 0 0 0 0 0
  8876. -2.3238 -0.2637 0.4033 H 0 0 0 0 0 0 0 0 0 0 0 0
  8877. -1.6631 1.1296 -1.5619 H 0 0 0 0 0 0 0 0 0 0 0 0
  8878. 2.3464 0.5572 -0.8156 H 0 0 0 0 0 0 0 0 0 0 0 0
  8879. 1.8678 -0.8621 1.1835 H 0 0 0 0 0 0 0 0 0 0 0 0
  8880. 1 2 2 0
  8881. 2 3 1 0
  8882. 3 4 2 0
  8883. 4 5 1 0
  8884. 5 6 2 0
  8885. 6 1 1 0
  8886. 1 7 1 0
  8887. 2 8 1 0
  8888. 3 9 1 0
  8889. 5 10 1 0
  8890. 6 11 1 0
  8891. M END
  8892. $$$$
  8893. RDKit 3D
  8894. 11 11 0 0 0 0 0 0 0 0999 V2000
  8895. -0.2702 -0.6728 0.9359 C 0 0 0 0 0 0 0 0 0 0 0 0
  8896. -1.2785 -0.1053 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
  8897. -0.9129 0.6746 -0.9216 C 0 0 0 0 0 0 0 0 0 0 0 0
  8898. 0.3682 0.9169 -1.2753 N 0 0 0 0 0 0 0 0 0 0 0 0
  8899. 1.3253 0.3525 -0.5071 C 0 0 0 0 0 0 0 0 0 0 0 0
  8900. 1.0589 -0.4417 0.5969 C 0 0 0 0 0 0 0 0 0 0 0 0
  8901. -0.5180 -1.2901 1.7945 H 0 0 0 0 0 0 0 0 0 0 0 0
  8902. -2.3238 -0.2662 0.4017 H 0 0 0 0 0 0 0 0 0 0 0 0
  8903. -1.6631 1.1394 -1.5548 H 0 0 0 0 0 0 0 0 0 0 0 0
  8904. 2.3464 0.5623 -0.8121 H 0 0 0 0 0 0 0 0 0 0 0 0
  8905. 1.8678 -0.8695 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8906. 1 2 2 0
  8907. 2 3 1 0
  8908. 3 4 2 0
  8909. 4 5 1 0
  8910. 5 6 2 0
  8911. 6 1 1 0
  8912. 1 7 1 0
  8913. 2 8 1 0
  8914. 3 9 1 0
  8915. 5 10 1 0
  8916. 6 11 1 0
  8917. M END
  8918. $$$$
  8919. RDKit 3D
  8920. 11 11 0 0 0 0 0 0 0 0999 V2000
  8921. -0.2702 -0.6787 0.9316 C 0 0 0 0 0 0 0 0 0 0 0 0
  8922. -1.2785 -0.1063 0.1633 C 0 0 0 0 0 0 0 0 0 0 0 0
  8923. -0.9129 0.6804 -0.9174 C 0 0 0 0 0 0 0 0 0 0 0 0
  8924. 0.3682 0.9249 -1.2695 N 0 0 0 0 0 0 0 0 0 0 0 0
  8925. 1.3253 0.3557 -0.5048 C 0 0 0 0 0 0 0 0 0 0 0 0
  8926. 1.0589 -0.4454 0.5941 C 0 0 0 0 0 0 0 0 0 0 0 0
  8927. -0.5180 -1.3014 1.7863 H 0 0 0 0 0 0 0 0 0 0 0 0
  8928. -2.3238 -0.2688 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0
  8929. -1.6631 1.1491 -1.5476 H 0 0 0 0 0 0 0 0 0 0 0 0
  8930. 2.3464 0.5674 -0.8086 H 0 0 0 0 0 0 0 0 0 0 0 0
  8931. 1.8678 -0.8769 1.1725 H 0 0 0 0 0 0 0 0 0 0 0 0
  8932. 1 2 2 0
  8933. 2 3 1 0
  8934. 3 4 2 0
  8935. 4 5 1 0
  8936. 5 6 2 0
  8937. 6 1 1 0
  8938. 1 7 1 0
  8939. 2 8 1 0
  8940. 3 9 1 0
  8941. 5 10 1 0
  8942. 6 11 1 0
  8943. M END
  8944. $$$$
  8945. RDKit 3D
  8946. 11 11 0 0 0 0 0 0 0 0999 V2000
  8947. -0.2702 -0.6846 0.9273 C 0 0 0 0 0 0 0 0 0 0 0 0
  8948. -1.2785 -0.1074 0.1626 C 0 0 0 0 0 0 0 0 0 0 0 0
  8949. -0.9129 0.6862 -0.9131 C 0 0 0 0 0 0 0 0 0 0 0 0
  8950. 0.3682 0.9329 -1.2637 N 0 0 0 0 0 0 0 0 0 0 0 0
  8951. 1.3253 0.3589 -0.5026 C 0 0 0 0 0 0 0 0 0 0 0 0
  8952. 1.0589 -0.4492 0.5913 C 0 0 0 0 0 0 0 0 0 0 0 0
  8953. -0.5180 -1.3126 1.7781 H 0 0 0 0 0 0 0 0 0 0 0 0
  8954. -2.3238 -0.2713 0.3983 H 0 0 0 0 0 0 0 0 0 0 0 0
  8955. -1.6631 1.1588 -1.5403 H 0 0 0 0 0 0 0 0 0 0 0 0
  8956. 2.3464 0.5725 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0
  8957. 1.8678 -0.8842 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  8958. 1 2 2 0
  8959. 2 3 1 0
  8960. 3 4 2 0
  8961. 4 5 1 0
  8962. 5 6 2 0
  8963. 6 1 1 0
  8964. 1 7 1 0
  8965. 2 8 1 0
  8966. 3 9 1 0
  8967. 5 10 1 0
  8968. 6 11 1 0
  8969. M END
  8970. $$$$
  8971. RDKit 3D
  8972. 11 11 0 0 0 0 0 0 0 0999 V2000
  8973. -0.2702 -0.6904 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0
  8974. -1.2785 -0.1084 0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0
  8975. -0.9129 0.6919 -0.9087 C 0 0 0 0 0 0 0 0 0 0 0 0
  8976. 0.3682 0.9408 -1.2578 N 0 0 0 0 0 0 0 0 0 0 0 0
  8977. 1.3253 0.3620 -0.5003 C 0 0 0 0 0 0 0 0 0 0 0 0
  8978. 1.0589 -0.4529 0.5885 C 0 0 0 0 0 0 0 0 0 0 0 0
  8979. -0.5180 -1.3237 1.7698 H 0 0 0 0 0 0 0 0 0 0 0 0
  8980. -2.3238 -0.2738 0.3966 H 0 0 0 0 0 0 0 0 0 0 0 0
  8981. -1.6631 1.1685 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0
  8982. 2.3464 0.5775 -0.8014 H 0 0 0 0 0 0 0 0 0 0 0 0
  8983. 1.8678 -0.8915 1.1614 H 0 0 0 0 0 0 0 0 0 0 0 0
  8984. 1 2 2 0
  8985. 2 3 1 0
  8986. 3 4 2 0
  8987. 4 5 1 0
  8988. 5 6 2 0
  8989. 6 1 1 0
  8990. 1 7 1 0
  8991. 2 8 1 0
  8992. 3 9 1 0
  8993. 5 10 1 0
  8994. 6 11 1 0
  8995. M END
  8996. $$$$
  8997. RDKit 3D
  8998. 11 11 0 0 0 0 0 0 0 0999 V2000
  8999. -0.2702 -0.6962 0.9187 C 0 0 0 0 0 0 0 0 0 0 0 0
  9000. -1.2785 -0.1094 0.1613 C 0 0 0 0 0 0 0 0 0 0 0 0
  9001. -0.9129 0.6976 -0.9044 C 0 0 0 0 0 0 0 0 0 0 0 0
  9002. 0.3682 0.9487 -1.2519 N 0 0 0 0 0 0 0 0 0 0 0 0
  9003. 1.3253 0.3651 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0
  9004. 1.0589 -0.4566 0.5856 C 0 0 0 0 0 0 0 0 0 0 0 0
  9005. -0.5180 -1.3348 1.7615 H 0 0 0 0 0 0 0 0 0 0 0 0
  9006. -2.3238 -0.2762 0.3949 H 0 0 0 0 0 0 0 0 0 0 0 0
  9007. -1.6631 1.1781 -1.5256 H 0 0 0 0 0 0 0 0 0 0 0 0
  9008. 2.3464 0.5825 -0.7977 H 0 0 0 0 0 0 0 0 0 0 0 0
  9009. 1.8678 -0.8988 1.1558 H 0 0 0 0 0 0 0 0 0 0 0 0
  9010. 1 2 2 0
  9011. 2 3 1 0
  9012. 3 4 2 0
  9013. 4 5 1 0
  9014. 5 6 2 0
  9015. 6 1 1 0
  9016. 1 7 1 0
  9017. 2 8 1 0
  9018. 3 9 1 0
  9019. 5 10 1 0
  9020. 6 11 1 0
  9021. M END
  9022. $$$$
  9023. RDKit 3D
  9024. 11 11 0 0 0 0 0 0 0 0999 V2000
  9025. -0.2702 -0.7019 0.9143 C 0 0 0 0 0 0 0 0 0 0 0 0
  9026. -1.2785 -0.1104 0.1606 C 0 0 0 0 0 0 0 0 0 0 0 0
  9027. -0.9129 0.7033 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9028. 0.3682 0.9565 -1.2459 N 0 0 0 0 0 0 0 0 0 0 0 0
  9029. 1.3253 0.3683 -0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0
  9030. 1.0589 -0.4602 0.5827 C 0 0 0 0 0 0 0 0 0 0 0 0
  9031. -0.5180 -1.3459 1.7531 H 0 0 0 0 0 0 0 0 0 0 0 0
  9032. -2.3238 -0.2787 0.3931 H 0 0 0 0 0 0 0 0 0 0 0 0
  9033. -1.6631 1.1876 -1.5182 H 0 0 0 0 0 0 0 0 0 0 0 0
  9034. 2.3464 0.5875 -0.7941 H 0 0 0 0 0 0 0 0 0 0 0 0
  9035. 1.8678 -0.9061 1.1501 H 0 0 0 0 0 0 0 0 0 0 0 0
  9036. 1 2 2 0
  9037. 2 3 1 0
  9038. 3 4 2 0
  9039. 4 5 1 0
  9040. 5 6 2 0
  9041. 6 1 1 0
  9042. 1 7 1 0
  9043. 2 8 1 0
  9044. 3 9 1 0
  9045. 5 10 1 0
  9046. 6 11 1 0
  9047. M END
  9048. $$$$
  9049. RDKit 3D
  9050. 11 11 0 0 0 0 0 0 0 0999 V2000
  9051. -0.2702 -0.7076 0.9098 C 0 0 0 0 0 0 0 0 0 0 0 0
  9052. -1.2785 -0.1114 0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0
  9053. -0.9129 0.7089 -0.8955 C 0 0 0 0 0 0 0 0 0 0 0 0
  9054. 0.3682 0.9643 -1.2399 N 0 0 0 0 0 0 0 0 0 0 0 0
  9055. 1.3253 0.3714 -0.4934 C 0 0 0 0 0 0 0 0 0 0 0 0
  9056. 1.0589 -0.4639 0.5798 C 0 0 0 0 0 0 0 0 0 0 0 0
  9057. -0.5180 -1.3569 1.7446 H 0 0 0 0 0 0 0 0 0 0 0 0
  9058. -2.3238 -0.2812 0.3914 H 0 0 0 0 0 0 0 0 0 0 0 0
  9059. -1.6631 1.1972 -1.5107 H 0 0 0 0 0 0 0 0 0 0 0 0
  9060. 2.3464 0.5925 -0.7904 H 0 0 0 0 0 0 0 0 0 0 0 0
  9061. 1.8678 -0.9133 1.1444 H 0 0 0 0 0 0 0 0 0 0 0 0
  9062. 1 2 2 0
  9063. 2 3 1 0
  9064. 3 4 2 0
  9065. 4 5 1 0
  9066. 5 6 2 0
  9067. 6 1 1 0
  9068. 1 7 1 0
  9069. 2 8 1 0
  9070. 3 9 1 0
  9071. 5 10 1 0
  9072. 6 11 1 0
  9073. M END
  9074. $$$$
  9075. RDKit 3D
  9076. 11 11 0 0 0 0 0 0 0 0999 V2000
  9077. -0.2702 -0.7133 0.9054 C 0 0 0 0 0 0 0 0 0 0 0 0
  9078. -1.2785 -0.1124 0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0
  9079. -0.9129 0.7145 -0.8911 C 0 0 0 0 0 0 0 0 0 0 0 0
  9080. 0.3682 0.9721 -1.2338 N 0 0 0 0 0 0 0 0 0 0 0 0
  9081. 1.3253 0.3745 -0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0
  9082. 1.0589 -0.4675 0.5769 C 0 0 0 0 0 0 0 0 0 0 0 0
  9083. -0.5180 -1.3678 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0
  9084. -2.3238 -0.2836 0.3896 H 0 0 0 0 0 0 0 0 0 0 0 0
  9085. -1.6631 1.2066 -1.5032 H 0 0 0 0 0 0 0 0 0 0 0 0
  9086. 2.3464 0.5975 -0.7866 H 0 0 0 0 0 0 0 0 0 0 0 0
  9087. 1.8678 -0.9204 1.1387 H 0 0 0 0 0 0 0 0 0 0 0 0
  9088. 1 2 2 0
  9089. 2 3 1 0
  9090. 3 4 2 0
  9091. 4 5 1 0
  9092. 5 6 2 0
  9093. 6 1 1 0
  9094. 1 7 1 0
  9095. 2 8 1 0
  9096. 3 9 1 0
  9097. 5 10 1 0
  9098. 6 11 1 0
  9099. M END
  9100. $$$$
  9101. RDKit 3D
  9102. 11 11 0 0 0 0 0 0 0 0999 V2000
  9103. -0.2702 -0.7190 0.9009 C 0 0 0 0 0 0 0 0 0 0 0 0
  9104. -1.2785 -0.1134 0.1585 C 0 0 0 0 0 0 0 0 0 0 0 0
  9105. -0.9129 0.7201 -0.8866 C 0 0 0 0 0 0 0 0 0 0 0 0
  9106. 0.3682 0.9798 -1.2277 N 0 0 0 0 0 0 0 0 0 0 0 0
  9107. 1.3253 0.3775 -0.4887 C 0 0 0 0 0 0 0 0 0 0 0 0
  9108. 1.0589 -0.4711 0.5739 C 0 0 0 0 0 0 0 0 0 0 0 0
  9109. -0.5180 -1.3787 1.7274 H 0 0 0 0 0 0 0 0 0 0 0 0
  9110. -2.3238 -0.2861 0.3878 H 0 0 0 0 0 0 0 0 0 0 0 0
  9111. -1.6631 1.2160 -1.4955 H 0 0 0 0 0 0 0 0 0 0 0 0
  9112. 2.3464 0.6024 -0.7828 H 0 0 0 0 0 0 0 0 0 0 0 0
  9113. 1.8678 -0.9276 1.1329 H 0 0 0 0 0 0 0 0 0 0 0 0
  9114. 1 2 2 0
  9115. 2 3 1 0
  9116. 3 4 2 0
  9117. 4 5 1 0
  9118. 5 6 2 0
  9119. 6 1 1 0
  9120. 1 7 1 0
  9121. 2 8 1 0
  9122. 3 9 1 0
  9123. 5 10 1 0
  9124. 6 11 1 0
  9125. M END
  9126. $$$$
  9127. RDKit 3D
  9128. 11 11 0 0 0 0 0 0 0 0999 V2000
  9129. -0.2702 -0.7247 0.8963 C 0 0 0 0 0 0 0 0 0 0 0 0
  9130. -1.2785 -0.1144 0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0
  9131. -0.9129 0.7256 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0
  9132. 0.3682 0.9875 -1.2215 N 0 0 0 0 0 0 0 0 0 0 0 0
  9133. 1.3253 0.3806 -0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0
  9134. 1.0589 -0.4747 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0
  9135. -0.5180 -1.3895 1.7187 H 0 0 0 0 0 0 0 0 0 0 0 0
  9136. -2.3238 -0.2885 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  9137. -1.6631 1.2254 -1.4879 H 0 0 0 0 0 0 0 0 0 0 0 0
  9138. 2.3464 0.6073 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0
  9139. 1.8678 -0.9347 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0
  9140. 1 2 2 0
  9141. 2 3 1 0
  9142. 3 4 2 0
  9143. 4 5 1 0
  9144. 5 6 2 0
  9145. 6 1 1 0
  9146. 1 7 1 0
  9147. 2 8 1 0
  9148. 3 9 1 0
  9149. 5 10 1 0
  9150. 6 11 1 0
  9151. M END
  9152. $$$$
  9153. RDKit 3D
  9154. 11 11 0 0 0 0 0 0 0 0999 V2000
  9155. -0.2702 -0.7303 0.8918 C 0 0 0 0 0 0 0 0 0 0 0 0
  9156. -1.2785 -0.1154 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0
  9157. -0.9129 0.7312 -0.8774 C 0 0 0 0 0 0 0 0 0 0 0 0
  9158. 0.3682 0.9952 -1.2152 N 0 0 0 0 0 0 0 0 0 0 0 0
  9159. 1.3253 0.3837 -0.4839 C 0 0 0 0 0 0 0 0 0 0 0 0
  9160. 1.0589 -0.4783 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0
  9161. -0.5180 -1.4003 1.7099 H 0 0 0 0 0 0 0 0 0 0 0 0
  9162. -2.3238 -0.2909 0.3842 H 0 0 0 0 0 0 0 0 0 0 0 0
  9163. -1.6631 1.2347 -1.4801 H 0 0 0 0 0 0 0 0 0 0 0 0
  9164. 2.3464 0.6122 -0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0
  9165. 1.8678 -0.9417 1.1211 H 0 0 0 0 0 0 0 0 0 0 0 0
  9166. 1 2 2 0
  9167. 2 3 1 0
  9168. 3 4 2 0
  9169. 4 5 1 0
  9170. 5 6 2 0
  9171. 6 1 1 0
  9172. 1 7 1 0
  9173. 2 8 1 0
  9174. 3 9 1 0
  9175. 5 10 1 0
  9176. 6 11 1 0
  9177. M END
  9178. $$$$
  9179. RDKit 3D
  9180. 11 11 0 0 0 0 0 0 0 0999 V2000
  9181. -0.2702 -0.7359 0.8872 C 0 0 0 0 0 0 0 0 0 0 0 0
  9182. -1.2785 -0.1164 0.1563 C 0 0 0 0 0 0 0 0 0 0 0 0
  9183. -0.9129 0.7367 -0.8728 C 0 0 0 0 0 0 0 0 0 0 0 0
  9184. 0.3682 1.0028 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0
  9185. 1.3253 0.3867 -0.4815 C 0 0 0 0 0 0 0 0 0 0 0 0
  9186. 1.0589 -0.4819 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0
  9187. -0.5180 -1.4110 1.7011 H 0 0 0 0 0 0 0 0 0 0 0 0
  9188. -2.3238 -0.2933 0.3823 H 0 0 0 0 0 0 0 0 0 0 0 0
  9189. -1.6631 1.2440 -1.4724 H 0 0 0 0 0 0 0 0 0 0 0 0
  9190. 2.3464 0.6170 -0.7713 H 0 0 0 0 0 0 0 0 0 0 0 0
  9191. 1.8678 -0.9488 1.1152 H 0 0 0 0 0 0 0 0 0 0 0 0
  9192. 1 2 2 0
  9193. 2 3 1 0
  9194. 3 4 2 0
  9195. 4 5 1 0
  9196. 5 6 2 0
  9197. 6 1 1 0
  9198. 1 7 1 0
  9199. 2 8 1 0
  9200. 3 9 1 0
  9201. 5 10 1 0
  9202. 6 11 1 0
  9203. M END
  9204. $$$$
  9205. RDKit 3D
  9206. 11 11 0 0 0 0 0 0 0 0999 V2000
  9207. -0.2702 -0.7414 0.8825 C 0 0 0 0 0 0 0 0 0 0 0 0
  9208. -1.2785 -0.1173 0.1556 C 0 0 0 0 0 0 0 0 0 0 0 0
  9209. -0.9129 0.7421 -0.8682 C 0 0 0 0 0 0 0 0 0 0 0 0
  9210. 0.3682 1.0104 -1.2026 N 0 0 0 0 0 0 0 0 0 0 0 0
  9211. 1.3253 0.3897 -0.4791 C 0 0 0 0 0 0 0 0 0 0 0 0
  9212. 1.0589 -0.4854 0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0
  9213. -0.5180 -1.4216 1.6922 H 0 0 0 0 0 0 0 0 0 0 0 0
  9214. -2.3238 -0.2957 0.3805 H 0 0 0 0 0 0 0 0 0 0 0 0
  9215. -1.6631 1.2532 -1.4645 H 0 0 0 0 0 0 0 0 0 0 0 0
  9216. 2.3464 0.6219 -0.7675 H 0 0 0 0 0 0 0 0 0 0 0 0
  9217. 1.8678 -0.9558 1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0
  9218. 1 2 2 0
  9219. 2 3 1 0
  9220. 3 4 2 0
  9221. 4 5 1 0
  9222. 5 6 2 0
  9223. 6 1 1 0
  9224. 1 7 1 0
  9225. 2 8 1 0
  9226. 3 9 1 0
  9227. 5 10 1 0
  9228. 6 11 1 0
  9229. M END
  9230. $$$$
  9231. RDKit 3D
  9232. 11 11 0 0 0 0 0 0 0 0999 V2000
  9233. -0.2702 -0.7470 0.8779 C 0 0 0 0 0 0 0 0 0 0 0 0
  9234. -1.2785 -0.1183 0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0
  9235. -0.9129 0.7476 -0.8635 C 0 0 0 0 0 0 0 0 0 0 0 0
  9236. 0.3682 1.0179 -1.1963 N 0 0 0 0 0 0 0 0 0 0 0 0
  9237. 1.3253 0.3927 -0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0
  9238. 1.0589 -0.4889 0.5589 C 0 0 0 0 0 0 0 0 0 0 0 0
  9239. -0.5180 -1.4322 1.6832 H 0 0 0 0 0 0 0 0 0 0 0 0
  9240. -2.3238 -0.2981 0.3786 H 0 0 0 0 0 0 0 0 0 0 0 0
  9241. -1.6631 1.2624 -1.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
  9242. 2.3464 0.6267 -0.7635 H 0 0 0 0 0 0 0 0 0 0 0 0
  9243. 1.8678 -0.9627 1.1032 H 0 0 0 0 0 0 0 0 0 0 0 0
  9244. 1 2 2 0
  9245. 2 3 1 0
  9246. 3 4 2 0
  9247. 4 5 1 0
  9248. 5 6 2 0
  9249. 6 1 1 0
  9250. 1 7 1 0
  9251. 2 8 1 0
  9252. 3 9 1 0
  9253. 5 10 1 0
  9254. 6 11 1 0
  9255. M END
  9256. $$$$
  9257. RDKit 3D
  9258. 11 11 0 0 0 0 0 0 0 0999 V2000
  9259. -0.2702 -0.7525 0.8731 C 0 0 0 0 0 0 0 0 0 0 0 0
  9260. -1.2785 -0.1193 0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0
  9261. -0.9129 0.7530 -0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0
  9262. 0.3682 1.0254 -1.1899 N 0 0 0 0 0 0 0 0 0 0 0 0
  9263. 1.3253 0.3957 -0.4741 C 0 0 0 0 0 0 0 0 0 0 0 0
  9264. 1.0589 -0.4924 0.5558 C 0 0 0 0 0 0 0 0 0 0 0 0
  9265. -0.5180 -1.4428 1.6742 H 0 0 0 0 0 0 0 0 0 0 0 0
  9266. -2.3238 -0.3005 0.3767 H 0 0 0 0 0 0 0 0 0 0 0 0
  9267. -1.6631 1.2715 -1.4486 H 0 0 0 0 0 0 0 0 0 0 0 0
  9268. 2.3464 0.6315 -0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0
  9269. 1.8678 -0.9696 1.0971 H 0 0 0 0 0 0 0 0 0 0 0 0
  9270. 1 2 2 0
  9271. 2 3 1 0
  9272. 3 4 2 0
  9273. 4 5 1 0
  9274. 5 6 2 0
  9275. 6 1 1 0
  9276. 1 7 1 0
  9277. 2 8 1 0
  9278. 3 9 1 0
  9279. 5 10 1 0
  9280. 6 11 1 0
  9281. M END
  9282. $$$$
  9283. RDKit 3D
  9284. 11 11 0 0 0 0 0 0 0 0999 V2000
  9285. -0.2702 -0.7579 0.8684 C 0 0 0 0 0 0 0 0 0 0 0 0
  9286. -1.2785 -0.1203 0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0
  9287. -0.9129 0.7584 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0
  9288. 0.3682 1.0329 -1.1834 N 0 0 0 0 0 0 0 0 0 0 0 0
  9289. 1.3253 0.3987 -0.4716 C 0 0 0 0 0 0 0 0 0 0 0 0
  9290. 1.0589 -0.4959 0.5527 C 0 0 0 0 0 0 0 0 0 0 0 0
  9291. -0.5180 -1.4533 1.6651 H 0 0 0 0 0 0 0 0 0 0 0 0
  9292. -2.3238 -0.3029 0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0
  9293. -1.6631 1.2806 -1.4406 H 0 0 0 0 0 0 0 0 0 0 0 0
  9294. 2.3464 0.6362 -0.7556 H 0 0 0 0 0 0 0 0 0 0 0 0
  9295. 1.8678 -0.9765 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0
  9296. 1 2 2 0
  9297. 2 3 1 0
  9298. 3 4 2 0
  9299. 4 5 1 0
  9300. 5 6 2 0
  9301. 6 1 1 0
  9302. 1 7 1 0
  9303. 2 8 1 0
  9304. 3 9 1 0
  9305. 5 10 1 0
  9306. 6 11 1 0
  9307. M END
  9308. $$$$
  9309. RDKit 3D
  9310. 11 11 0 0 0 0 0 0 0 0999 V2000
  9311. -0.2702 -0.7634 0.8636 C 0 0 0 0 0 0 0 0 0 0 0 0
  9312. -1.2785 -0.1212 0.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  9313. -0.9129 0.7637 -0.8493 C 0 0 0 0 0 0 0 0 0 0 0 0
  9314. 0.3682 1.0403 -1.1769 N 0 0 0 0 0 0 0 0 0 0 0 0
  9315. 1.3253 0.4016 -0.4691 C 0 0 0 0 0 0 0 0 0 0 0 0
  9316. 1.0589 -0.4994 0.5495 C 0 0 0 0 0 0 0 0 0 0 0 0
  9317. -0.5180 -1.4637 1.6559 H 0 0 0 0 0 0 0 0 0 0 0 0
  9318. -2.3238 -0.3052 0.3729 H 0 0 0 0 0 0 0 0 0 0 0 0
  9319. -1.6631 1.2896 -1.4326 H 0 0 0 0 0 0 0 0 0 0 0 0
  9320. 2.3464 0.6410 -0.7516 H 0 0 0 0 0 0 0 0 0 0 0 0
  9321. 1.8678 -0.9833 1.0848 H 0 0 0 0 0 0 0 0 0 0 0 0
  9322. 1 2 2 0
  9323. 2 3 1 0
  9324. 3 4 2 0
  9325. 4 5 1 0
  9326. 5 6 2 0
  9327. 6 1 1 0
  9328. 1 7 1 0
  9329. 2 8 1 0
  9330. 3 9 1 0
  9331. 5 10 1 0
  9332. 6 11 1 0
  9333. M END
  9334. $$$$
  9335. RDKit 3D
  9336. 11 11 0 0 0 0 0 0 0 0999 V2000
  9337. -0.2702 -0.7688 0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0
  9338. -1.2785 -0.1222 0.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
  9339. -0.9129 0.7690 -0.8444 C 0 0 0 0 0 0 0 0 0 0 0 0
  9340. 0.3682 1.0476 -1.1703 N 0 0 0 0 0 0 0 0 0 0 0 0
  9341. 1.3253 0.4046 -0.4666 C 0 0 0 0 0 0 0 0 0 0 0 0
  9342. 1.0589 -0.5028 0.5464 C 0 0 0 0 0 0 0 0 0 0 0 0
  9343. -0.5180 -1.4741 1.6467 H 0 0 0 0 0 0 0 0 0 0 0 0
  9344. -2.3238 -0.3075 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  9345. -1.6631 1.2986 -1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0
  9346. 2.3464 0.6457 -0.7475 H 0 0 0 0 0 0 0 0 0 0 0 0
  9347. 1.8678 -0.9901 1.0786 H 0 0 0 0 0 0 0 0 0 0 0 0
  9348. 1 2 2 0
  9349. 2 3 1 0
  9350. 3 4 2 0
  9351. 4 5 1 0
  9352. 5 6 2 0
  9353. 6 1 1 0
  9354. 1 7 1 0
  9355. 2 8 1 0
  9356. 3 9 1 0
  9357. 5 10 1 0
  9358. 6 11 1 0
  9359. M END
  9360. $$$$
  9361. RDKit 3D
  9362. 11 11 0 0 0 0 0 0 0 0999 V2000
  9363. -0.2702 -0.7742 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0
  9364. -1.2785 -0.1231 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  9365. -0.9129 0.7743 -0.8396 C 0 0 0 0 0 0 0 0 0 0 0 0
  9366. 0.3682 1.0550 -1.1637 N 0 0 0 0 0 0 0 0 0 0 0 0
  9367. 1.3253 0.4075 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0
  9368. 1.0589 -0.5062 0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0
  9369. -0.5180 -1.4844 1.6374 H 0 0 0 0 0 0 0 0 0 0 0 0
  9370. -2.3238 -0.3099 0.3691 H 0 0 0 0 0 0 0 0 0 0 0 0
  9371. -1.6631 1.3075 -1.4162 H 0 0 0 0 0 0 0 0 0 0 0 0
  9372. 2.3464 0.6504 -0.7435 H 0 0 0 0 0 0 0 0 0 0 0 0
  9373. 1.8678 -0.9969 1.0724 H 0 0 0 0 0 0 0 0 0 0 0 0
  9374. 1 2 2 0
  9375. 2 3 1 0
  9376. 3 4 2 0
  9377. 4 5 1 0
  9378. 5 6 2 0
  9379. 6 1 1 0
  9380. 1 7 1 0
  9381. 2 8 1 0
  9382. 3 9 1 0
  9383. 5 10 1 0
  9384. 6 11 1 0
  9385. M END
  9386. $$$$
  9387. RDKit 3D
  9388. 11 11 0 0 0 0 0 0 0 0999 V2000
  9389. -0.2702 -0.7795 0.8491 C 0 0 0 0 0 0 0 0 0 0 0 0
  9390. -1.2785 -0.1241 0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0
  9391. -0.9129 0.7796 -0.8347 C 0 0 0 0 0 0 0 0 0 0 0 0
  9392. 0.3682 1.0623 -1.1571 N 0 0 0 0 0 0 0 0 0 0 0 0
  9393. 1.3253 0.4104 -0.4615 C 0 0 0 0 0 0 0 0 0 0 0 0
  9394. 1.0589 -0.5096 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0
  9395. -0.5180 -1.4947 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0
  9396. -2.3238 -0.3122 0.3671 H 0 0 0 0 0 0 0 0 0 0 0 0
  9397. -1.6631 1.3164 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0
  9398. 2.3464 0.6550 -0.7394 H 0 0 0 0 0 0 0 0 0 0 0 0
  9399. 1.8678 -1.0036 1.0661 H 0 0 0 0 0 0 0 0 0 0 0 0
  9400. 1 2 2 0
  9401. 2 3 1 0
  9402. 3 4 2 0
  9403. 4 5 1 0
  9404. 5 6 2 0
  9405. 6 1 1 0
  9406. 1 7 1 0
  9407. 2 8 1 0
  9408. 3 9 1 0
  9409. 5 10 1 0
  9410. 6 11 1 0
  9411. M END
  9412. $$$$
  9413. RDKit 3D
  9414. 11 11 0 0 0 0 0 0 0 0999 V2000
  9415. -0.2702 -0.7848 0.8442 C 0 0 0 0 0 0 0 0 0 0 0 0
  9416. -1.2785 -0.1250 0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0
  9417. -0.9129 0.7848 -0.8298 C 0 0 0 0 0 0 0 0 0 0 0 0
  9418. 0.3682 1.0695 -1.1504 N 0 0 0 0 0 0 0 0 0 0 0 0
  9419. 1.3253 0.4133 -0.4589 C 0 0 0 0 0 0 0 0 0 0 0 0
  9420. 1.0589 -0.5130 0.5368 C 0 0 0 0 0 0 0 0 0 0 0 0
  9421. -0.5180 -1.5049 1.6186 H 0 0 0 0 0 0 0 0 0 0 0 0
  9422. -2.3238 -0.3145 0.3651 H 0 0 0 0 0 0 0 0 0 0 0 0
  9423. -1.6631 1.3252 -1.3997 H 0 0 0 0 0 0 0 0 0 0 0 0
  9424. 2.3464 0.6597 -0.7352 H 0 0 0 0 0 0 0 0 0 0 0 0
  9425. 1.8678 -1.0103 1.0598 H 0 0 0 0 0 0 0 0 0 0 0 0
  9426. 1 2 2 0
  9427. 2 3 1 0
  9428. 3 4 2 0
  9429. 4 5 1 0
  9430. 5 6 2 0
  9431. 6 1 1 0
  9432. 1 7 1 0
  9433. 2 8 1 0
  9434. 3 9 1 0
  9435. 5 10 1 0
  9436. 6 11 1 0
  9437. M END
  9438. $$$$
  9439. RDKit 3D
  9440. 11 11 0 0 0 0 0 0 0 0999 V2000
  9441. -0.2702 -0.7901 0.8392 C 0 0 0 0 0 0 0 0 0 0 0 0
  9442. -1.2785 -0.1260 0.1487 C 0 0 0 0 0 0 0 0 0 0 0 0
  9443. -0.9129 0.7900 -0.8248 C 0 0 0 0 0 0 0 0 0 0 0 0
  9444. 0.3682 1.0767 -1.1436 N 0 0 0 0 0 0 0 0 0 0 0 0
  9445. 1.3253 0.4162 -0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0
  9446. 1.0589 -0.5164 0.5336 C 0 0 0 0 0 0 0 0 0 0 0 0
  9447. -0.5180 -1.5150 1.6091 H 0 0 0 0 0 0 0 0 0 0 0 0
  9448. -2.3238 -0.3168 0.3632 H 0 0 0 0 0 0 0 0 0 0 0 0
  9449. -1.6631 1.3340 -1.3913 H 0 0 0 0 0 0 0 0 0 0 0 0
  9450. 2.3464 0.6643 -0.7311 H 0 0 0 0 0 0 0 0 0 0 0 0
  9451. 1.8678 -1.0169 1.0534 H 0 0 0 0 0 0 0 0 0 0 0 0
  9452. 1 2 2 0
  9453. 2 3 1 0
  9454. 3 4 2 0
  9455. 4 5 1 0
  9456. 5 6 2 0
  9457. 6 1 1 0
  9458. 1 7 1 0
  9459. 2 8 1 0
  9460. 3 9 1 0
  9461. 5 10 1 0
  9462. 6 11 1 0
  9463. M END
  9464. $$$$
  9465. RDKit 3D
  9466. 11 11 0 0 0 0 0 0 0 0999 V2000
  9467. -0.2702 -0.7954 0.8342 C 0 0 0 0 0 0 0 0 0 0 0 0
  9468. -1.2785 -0.1269 0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0
  9469. -0.9129 0.7952 -0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0
  9470. 0.3682 1.0839 -1.1368 N 0 0 0 0 0 0 0 0 0 0 0 0
  9471. 1.3253 0.4190 -0.4537 C 0 0 0 0 0 0 0 0 0 0 0 0
  9472. 1.0589 -0.5197 0.5303 C 0 0 0 0 0 0 0 0 0 0 0 0
  9473. -0.5180 -1.5251 1.5996 H 0 0 0 0 0 0 0 0 0 0 0 0
  9474. -2.3238 -0.3190 0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0
  9475. -1.6631 1.3427 -1.3829 H 0 0 0 0 0 0 0 0 0 0 0 0
  9476. 2.3464 0.6688 -0.7269 H 0 0 0 0 0 0 0 0 0 0 0 0
  9477. 1.8678 -1.0235 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0
  9478. 1 2 2 0
  9479. 2 3 1 0
  9480. 3 4 2 0
  9481. 4 5 1 0
  9482. 5 6 2 0
  9483. 6 1 1 0
  9484. 1 7 1 0
  9485. 2 8 1 0
  9486. 3 9 1 0
  9487. 5 10 1 0
  9488. 6 11 1 0
  9489. M END
  9490. $$$$
  9491. RDKit 3D
  9492. 11 11 0 0 0 0 0 0 0 0999 V2000
  9493. -0.2702 -0.8006 0.8292 C 0 0 0 0 0 0 0 0 0 0 0 0
  9494. -1.2785 -0.1278 0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0
  9495. -0.9129 0.8003 -0.8149 C 0 0 0 0 0 0 0 0 0 0 0 0
  9496. 0.3682 1.0910 -1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0
  9497. 1.3253 0.4219 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0
  9498. 1.0589 -0.5231 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0
  9499. -0.5180 -1.5351 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0
  9500. -2.3238 -0.3213 0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0
  9501. -1.6631 1.3514 -1.3745 H 0 0 0 0 0 0 0 0 0 0 0 0
  9502. 2.3464 0.6734 -0.7227 H 0 0 0 0 0 0 0 0 0 0 0 0
  9503. 1.8678 -1.0301 1.0405 H 0 0 0 0 0 0 0 0 0 0 0 0
  9504. 1 2 2 0
  9505. 2 3 1 0
  9506. 3 4 2 0
  9507. 4 5 1 0
  9508. 5 6 2 0
  9509. 6 1 1 0
  9510. 1 7 1 0
  9511. 2 8 1 0
  9512. 3 9 1 0
  9513. 5 10 1 0
  9514. 6 11 1 0
  9515. M END
  9516. $$$$
  9517. RDKit 3D
  9518. 11 11 0 0 0 0 0 0 0 0999 V2000
  9519. -0.2702 -0.8058 0.8242 C 0 0 0 0 0 0 0 0 0 0 0 0
  9520. -1.2785 -0.1287 0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0
  9521. -0.9129 0.8054 -0.8098 C 0 0 0 0 0 0 0 0 0 0 0 0
  9522. 0.3682 1.0981 -1.1231 N 0 0 0 0 0 0 0 0 0 0 0 0
  9523. 1.3253 0.4247 -0.4484 C 0 0 0 0 0 0 0 0 0 0 0 0
  9524. 1.0589 -0.5264 0.5238 C 0 0 0 0 0 0 0 0 0 0 0 0
  9525. -0.5180 -1.5451 1.5803 H 0 0 0 0 0 0 0 0 0 0 0 0
  9526. -2.3238 -0.3236 0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0
  9527. -1.6631 1.3600 -1.3659 H 0 0 0 0 0 0 0 0 0 0 0 0
  9528. 2.3464 0.6779 -0.7184 H 0 0 0 0 0 0 0 0 0 0 0 0
  9529. 1.8678 -1.0366 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0
  9530. 1 2 2 0
  9531. 2 3 1 0
  9532. 3 4 2 0
  9533. 4 5 1 0
  9534. 5 6 2 0
  9535. 6 1 1 0
  9536. 1 7 1 0
  9537. 2 8 1 0
  9538. 3 9 1 0
  9539. 5 10 1 0
  9540. 6 11 1 0
  9541. M END
  9542. $$$$
  9543. RDKit 3D
  9544. 11 11 0 0 0 0 0 0 0 0999 V2000
  9545. -0.2702 -0.8110 0.8191 C 0 0 0 0 0 0 0 0 0 0 0 0
  9546. -1.2785 -0.1297 0.1455 C 0 0 0 0 0 0 0 0 0 0 0 0
  9547. -0.9129 0.8105 -0.8047 C 0 0 0 0 0 0 0 0 0 0 0 0
  9548. 0.3682 1.1051 -1.1162 N 0 0 0 0 0 0 0 0 0 0 0 0
  9549. 1.3253 0.4275 -0.4457 C 0 0 0 0 0 0 0 0 0 0 0 0
  9550. 1.0589 -0.5296 0.5204 C 0 0 0 0 0 0 0 0 0 0 0 0
  9551. -0.5180 -1.5550 1.5706 H 0 0 0 0 0 0 0 0 0 0 0 0
  9552. -2.3238 -0.3258 0.3551 H 0 0 0 0 0 0 0 0 0 0 0 0
  9553. -1.6631 1.3686 -1.3574 H 0 0 0 0 0 0 0 0 0 0 0 0
  9554. 2.3464 0.6824 -0.7142 H 0 0 0 0 0 0 0 0 0 0 0 0
  9555. 1.8678 -1.0431 1.0275 H 0 0 0 0 0 0 0 0 0 0 0 0
  9556. 1 2 2 0
  9557. 2 3 1 0
  9558. 3 4 2 0
  9559. 4 5 1 0
  9560. 5 6 2 0
  9561. 6 1 1 0
  9562. 1 7 1 0
  9563. 2 8 1 0
  9564. 3 9 1 0
  9565. 5 10 1 0
  9566. 6 11 1 0
  9567. M END
  9568. $$$$
  9569. RDKit 3D
  9570. 11 11 0 0 0 0 0 0 0 0999 V2000
  9571. -0.2702 -0.8161 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0
  9572. -1.2785 -0.1306 0.1446 C 0 0 0 0 0 0 0 0 0 0 0 0
  9573. -0.9129 0.8155 -0.7996 C 0 0 0 0 0 0 0 0 0 0 0 0
  9574. 0.3682 1.1121 -1.1092 N 0 0 0 0 0 0 0 0 0 0 0 0
  9575. 1.3253 0.4303 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0
  9576. 1.0589 -0.5329 0.5171 C 0 0 0 0 0 0 0 0 0 0 0 0
  9577. -0.5180 -1.5648 1.5608 H 0 0 0 0 0 0 0 0 0 0 0 0
  9578. -2.3238 -0.3280 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0
  9579. -1.6631 1.3771 -1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0
  9580. 2.3464 0.6869 -0.7099 H 0 0 0 0 0 0 0 0 0 0 0 0
  9581. 1.8678 -1.0495 1.0209 H 0 0 0 0 0 0 0 0 0 0 0 0
  9582. 1 2 2 0
  9583. 2 3 1 0
  9584. 3 4 2 0
  9585. 4 5 1 0
  9586. 5 6 2 0
  9587. 6 1 1 0
  9588. 1 7 1 0
  9589. 2 8 1 0
  9590. 3 9 1 0
  9591. 5 10 1 0
  9592. 6 11 1 0
  9593. M END
  9594. $$$$
  9595. RDKit 3D
  9596. 11 11 0 0 0 0 0 0 0 0999 V2000
  9597. -0.2702 -0.8212 0.8088 C 0 0 0 0 0 0 0 0 0 0 0 0
  9598. -1.2785 -0.1315 0.1438 C 0 0 0 0 0 0 0 0 0 0 0 0
  9599. -0.9129 0.8206 -0.7945 C 0 0 0 0 0 0 0 0 0 0 0 0
  9600. 0.3682 1.1191 -1.1022 N 0 0 0 0 0 0 0 0 0 0 0 0
  9601. 1.3253 0.4331 -0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0
  9602. 1.0589 -0.5361 0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0
  9603. -0.5180 -1.5746 1.5509 H 0 0 0 0 0 0 0 0 0 0 0 0
  9604. -2.3238 -0.3302 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0
  9605. -1.6631 1.3855 -1.3401 H 0 0 0 0 0 0 0 0 0 0 0 0
  9606. 2.3464 0.6913 -0.7055 H 0 0 0 0 0 0 0 0 0 0 0 0
  9607. 1.8678 -1.0559 1.0143 H 0 0 0 0 0 0 0 0 0 0 0 0
  9608. 1 2 2 0
  9609. 2 3 1 0
  9610. 3 4 2 0
  9611. 4 5 1 0
  9612. 5 6 2 0
  9613. 6 1 1 0
  9614. 1 7 1 0
  9615. 2 8 1 0
  9616. 3 9 1 0
  9617. 5 10 1 0
  9618. 6 11 1 0
  9619. M END
  9620. $$$$
  9621. RDKit 3D
  9622. 11 11 0 0 0 0 0 0 0 0999 V2000
  9623. -0.2702 -0.8263 0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0
  9624. -1.2785 -0.1324 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0
  9625. -0.9129 0.8255 -0.7893 C 0 0 0 0 0 0 0 0 0 0 0 0
  9626. 0.3682 1.1260 -1.0952 N 0 0 0 0 0 0 0 0 0 0 0 0
  9627. 1.3253 0.4358 -0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0
  9628. 1.0589 -0.5394 0.5104 C 0 0 0 0 0 0 0 0 0 0 0 0
  9629. -0.5180 -1.5843 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0
  9630. -2.3238 -0.3324 0.3489 H 0 0 0 0 0 0 0 0 0 0 0 0
  9631. -1.6631 1.3939 -1.3313 H 0 0 0 0 0 0 0 0 0 0 0 0
  9632. 2.3464 0.6958 -0.7012 H 0 0 0 0 0 0 0 0 0 0 0 0
  9633. 1.8678 -1.0623 1.0077 H 0 0 0 0 0 0 0 0 0 0 0 0
  9634. 1 2 2 0
  9635. 2 3 1 0
  9636. 3 4 2 0
  9637. 4 5 1 0
  9638. 5 6 2 0
  9639. 6 1 1 0
  9640. 1 7 1 0
  9641. 2 8 1 0
  9642. 3 9 1 0
  9643. 5 10 1 0
  9644. 6 11 1 0
  9645. M END
  9646. $$$$
  9647. RDKit 3D
  9648. 11 11 0 0 0 0 0 0 0 0999 V2000
  9649. -0.2702 -0.8313 0.7985 C 0 0 0 0 0 0 0 0 0 0 0 0
  9650. -1.2785 -0.1333 0.1422 C 0 0 0 0 0 0 0 0 0 0 0 0
  9651. -0.9129 0.8305 -0.7841 C 0 0 0 0 0 0 0 0 0 0 0 0
  9652. 0.3682 1.1328 -1.0881 N 0 0 0 0 0 0 0 0 0 0 0 0
  9653. 1.3253 0.4386 -0.4348 C 0 0 0 0 0 0 0 0 0 0 0 0
  9654. 1.0589 -0.5425 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0
  9655. -0.5180 -1.5939 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0
  9656. -2.3238 -0.3346 0.3468 H 0 0 0 0 0 0 0 0 0 0 0 0
  9657. -1.6631 1.4022 -1.3226 H 0 0 0 0 0 0 0 0 0 0 0 0
  9658. 2.3464 0.7002 -0.6968 H 0 0 0 0 0 0 0 0 0 0 0 0
  9659. 1.8678 -1.0686 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  9660. 1 2 2 0
  9661. 2 3 1 0
  9662. 3 4 2 0
  9663. 4 5 1 0
  9664. 5 6 2 0
  9665. 6 1 1 0
  9666. 1 7 1 0
  9667. 2 8 1 0
  9668. 3 9 1 0
  9669. 5 10 1 0
  9670. 6 11 1 0
  9671. M END
  9672. $$$$
  9673. RDKit 3D
  9674. 11 11 0 0 0 0 0 0 0 0999 V2000
  9675. -0.2702 -0.8363 0.7932 C 0 0 0 0 0 0 0 0 0 0 0 0
  9676. -1.2785 -0.1342 0.1413 C 0 0 0 0 0 0 0 0 0 0 0 0
  9677. -0.9129 0.8354 -0.7789 C 0 0 0 0 0 0 0 0 0 0 0 0
  9678. 0.3682 1.1396 -1.0809 N 0 0 0 0 0 0 0 0 0 0 0 0
  9679. 1.3253 0.4413 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0
  9680. 1.0589 -0.5457 0.5035 C 0 0 0 0 0 0 0 0 0 0 0 0
  9681. -0.5180 -1.6035 1.5209 H 0 0 0 0 0 0 0 0 0 0 0 0
  9682. -2.3238 -0.3368 0.3447 H 0 0 0 0 0 0 0 0 0 0 0 0
  9683. -1.6631 1.4105 -1.3137 H 0 0 0 0 0 0 0 0 0 0 0 0
  9684. 2.3464 0.7045 -0.6924 H 0 0 0 0 0 0 0 0 0 0 0 0
  9685. 1.8678 -1.0748 0.9942 H 0 0 0 0 0 0 0 0 0 0 0 0
  9686. 1 2 2 0
  9687. 2 3 1 0
  9688. 3 4 2 0
  9689. 4 5 1 0
  9690. 5 6 2 0
  9691. 6 1 1 0
  9692. 1 7 1 0
  9693. 2 8 1 0
  9694. 3 9 1 0
  9695. 5 10 1 0
  9696. 6 11 1 0
  9697. M END
  9698. $$$$
  9699. RDKit 3D
  9700. 11 11 0 0 0 0 0 0 0 0999 V2000
  9701. -0.2702 -0.8413 0.7879 C 0 0 0 0 0 0 0 0 0 0 0 0
  9702. -1.2785 -0.1350 0.1405 C 0 0 0 0 0 0 0 0 0 0 0 0
  9703. -0.9129 0.8403 -0.7736 C 0 0 0 0 0 0 0 0 0 0 0 0
  9704. 0.3682 1.1464 -1.0738 N 0 0 0 0 0 0 0 0 0 0 0 0
  9705. 1.3253 0.4440 -0.4292 C 0 0 0 0 0 0 0 0 0 0 0 0
  9706. 1.0589 -0.5489 0.5001 C 0 0 0 0 0 0 0 0 0 0 0 0
  9707. -0.5180 -1.6131 1.5108 H 0 0 0 0 0 0 0 0 0 0 0 0
  9708. -2.3238 -0.3389 0.3426 H 0 0 0 0 0 0 0 0 0 0 0 0
  9709. -1.6631 1.4187 -1.3048 H 0 0 0 0 0 0 0 0 0 0 0 0
  9710. 2.3464 0.7089 -0.6879 H 0 0 0 0 0 0 0 0 0 0 0 0
  9711. 1.8678 -1.0811 0.9875 H 0 0 0 0 0 0 0 0 0 0 0 0
  9712. 1 2 2 0
  9713. 2 3 1 0
  9714. 3 4 2 0
  9715. 4 5 1 0
  9716. 5 6 2 0
  9717. 6 1 1 0
  9718. 1 7 1 0
  9719. 2 8 1 0
  9720. 3 9 1 0
  9721. 5 10 1 0
  9722. 6 11 1 0
  9723. M END
  9724. $$$$
  9725. RDKit 3D
  9726. 11 11 0 0 0 0 0 0 0 0999 V2000
  9727. -0.2702 -0.8462 0.7826 C 0 0 0 0 0 0 0 0 0 0 0 0
  9728. -1.2785 -0.1359 0.1396 C 0 0 0 0 0 0 0 0 0 0 0 0
  9729. -0.9129 0.8451 -0.7683 C 0 0 0 0 0 0 0 0 0 0 0 0
  9730. 0.3682 1.1531 -1.0665 N 0 0 0 0 0 0 0 0 0 0 0 0
  9731. 1.3253 0.4467 -0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0
  9732. 1.0589 -0.5520 0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0
  9733. -0.5180 -1.6225 1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0
  9734. -2.3238 -0.3411 0.3404 H 0 0 0 0 0 0 0 0 0 0 0 0
  9735. -1.6631 1.4269 -1.2959 H 0 0 0 0 0 0 0 0 0 0 0 0
  9736. 2.3464 0.7132 -0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0
  9737. 1.8678 -1.0872 0.9807 H 0 0 0 0 0 0 0 0 0 0 0 0
  9738. 1 2 2 0
  9739. 2 3 1 0
  9740. 3 4 2 0
  9741. 4 5 1 0
  9742. 5 6 2 0
  9743. 6 1 1 0
  9744. 1 7 1 0
  9745. 2 8 1 0
  9746. 3 9 1 0
  9747. 5 10 1 0
  9748. 6 11 1 0
  9749. M END
  9750. $$$$
  9751. RDKit 3D
  9752. 11 11 0 0 0 0 0 0 0 0999 V2000
  9753. -0.2702 -0.8511 0.7773 C 0 0 0 0 0 0 0 0 0 0 0 0
  9754. -1.2785 -0.1368 0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0
  9755. -0.9129 0.8499 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0
  9756. 0.3682 1.1598 -1.0593 N 0 0 0 0 0 0 0 0 0 0 0 0
  9757. 1.3253 0.4493 -0.4236 C 0 0 0 0 0 0 0 0 0 0 0 0
  9758. 1.0589 -0.5551 0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0
  9759. -0.5180 -1.6319 1.4904 H 0 0 0 0 0 0 0 0 0 0 0 0
  9760. -2.3238 -0.3432 0.3383 H 0 0 0 0 0 0 0 0 0 0 0 0
  9761. -1.6631 1.4350 -1.2869 H 0 0 0 0 0 0 0 0 0 0 0 0
  9762. 2.3464 0.7174 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0
  9763. 1.8678 -1.0934 0.9738 H 0 0 0 0 0 0 0 0 0 0 0 0
  9764. 1 2 2 0
  9765. 2 3 1 0
  9766. 3 4 2 0
  9767. 4 5 1 0
  9768. 5 6 2 0
  9769. 6 1 1 0
  9770. 1 7 1 0
  9771. 2 8 1 0
  9772. 3 9 1 0
  9773. 5 10 1 0
  9774. 6 11 1 0
  9775. M END
  9776. $$$$
  9777. RDKit 3D
  9778. 11 11 0 0 0 0 0 0 0 0999 V2000
  9779. -0.2702 -0.8560 0.7719 C 0 0 0 0 0 0 0 0 0 0 0 0
  9780. -1.2785 -0.1377 0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0
  9781. -0.9129 0.8547 -0.7576 C 0 0 0 0 0 0 0 0 0 0 0 0
  9782. 0.3682 1.1664 -1.0520 N 0 0 0 0 0 0 0 0 0 0 0 0
  9783. 1.3253 0.4520 -0.4208 C 0 0 0 0 0 0 0 0 0 0 0 0
  9784. 1.0589 -0.5582 0.4897 C 0 0 0 0 0 0 0 0 0 0 0 0
  9785. -0.5180 -1.6412 1.4802 H 0 0 0 0 0 0 0 0 0 0 0 0
  9786. -2.3238 -0.3453 0.3361 H 0 0 0 0 0 0 0 0 0 0 0 0
  9787. -1.6631 1.4431 -1.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
  9788. 2.3464 0.7217 -0.6744 H 0 0 0 0 0 0 0 0 0 0 0 0
  9789. 1.8678 -1.0995 0.9669 H 0 0 0 0 0 0 0 0 0 0 0 0
  9790. 1 2 2 0
  9791. 2 3 1 0
  9792. 3 4 2 0
  9793. 4 5 1 0
  9794. 5 6 2 0
  9795. 6 1 1 0
  9796. 1 7 1 0
  9797. 2 8 1 0
  9798. 3 9 1 0
  9799. 5 10 1 0
  9800. 6 11 1 0
  9801. M END
  9802. $$$$
  9803. RDKit 3D
  9804. 11 11 0 0 0 0 0 0 0 0999 V2000
  9805. -0.2702 -0.8608 0.7666 C 0 0 0 0 0 0 0 0 0 0 0 0
  9806. -1.2785 -0.1385 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  9807. -0.9129 0.8594 -0.7523 C 0 0 0 0 0 0 0 0 0 0 0 0
  9808. 0.3682 1.1730 -1.0446 N 0 0 0 0 0 0 0 0 0 0 0 0
  9809. 1.3253 0.4546 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0
  9810. 1.0589 -0.5613 0.4862 C 0 0 0 0 0 0 0 0 0 0 0 0
  9811. -0.5180 -1.6505 1.4698 H 0 0 0 0 0 0 0 0 0 0 0 0
  9812. -2.3238 -0.3474 0.3339 H 0 0 0 0 0 0 0 0 0 0 0 0
  9813. -1.6631 1.4511 -1.2688 H 0 0 0 0 0 0 0 0 0 0 0 0
  9814. 2.3464 0.7259 -0.6699 H 0 0 0 0 0 0 0 0 0 0 0 0
  9815. 1.8678 -1.1055 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0
  9816. 1 2 2 0
  9817. 2 3 1 0
  9818. 3 4 2 0
  9819. 4 5 1 0
  9820. 5 6 2 0
  9821. 6 1 1 0
  9822. 1 7 1 0
  9823. 2 8 1 0
  9824. 3 9 1 0
  9825. 5 10 1 0
  9826. 6 11 1 0
  9827. M END
  9828. $$$$
  9829. RDKit 3D
  9830. 11 11 0 0 0 0 0 0 0 0999 V2000
  9831. -0.2702 -0.8656 0.7611 C 0 0 0 0 0 0 0 0 0 0 0 0
  9832. -1.2785 -0.1394 0.1362 C 0 0 0 0 0 0 0 0 0 0 0 0
  9833. -0.9129 0.8641 -0.7468 C 0 0 0 0 0 0 0 0 0 0 0 0
  9834. 0.3682 1.1796 -1.0372 N 0 0 0 0 0 0 0 0 0 0 0 0
  9835. 1.3253 0.4573 -0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0
  9836. 1.0589 -0.5643 0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0
  9837. -0.5180 -1.6597 1.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
  9838. -2.3238 -0.3495 0.3317 H 0 0 0 0 0 0 0 0 0 0 0 0
  9839. -1.6631 1.4590 -1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0
  9840. 2.3464 0.7301 -0.6653 H 0 0 0 0 0 0 0 0 0 0 0 0
  9841. 1.8678 -1.1115 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  9842. 1 2 2 0
  9843. 2 3 1 0
  9844. 3 4 2 0
  9845. 4 5 1 0
  9846. 5 6 2 0
  9847. 6 1 1 0
  9848. 1 7 1 0
  9849. 2 8 1 0
  9850. 3 9 1 0
  9851. 5 10 1 0
  9852. 6 11 1 0
  9853. M END
  9854. $$$$
  9855. RDKit 3D
  9856. 11 11 0 0 0 0 0 0 0 0999 V2000
  9857. -0.2702 -0.8704 0.7557 C 0 0 0 0 0 0 0 0 0 0 0 0
  9858. -1.2785 -0.1402 0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0
  9859. -0.9129 0.8688 -0.7414 C 0 0 0 0 0 0 0 0 0 0 0 0
  9860. 0.3682 1.1861 -1.0298 N 0 0 0 0 0 0 0 0 0 0 0 0
  9861. 1.3253 0.4599 -0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0
  9862. 1.0589 -0.5673 0.4791 C 0 0 0 0 0 0 0 0 0 0 0 0
  9863. -0.5180 -1.6689 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
  9864. -2.3238 -0.3516 0.3295 H 0 0 0 0 0 0 0 0 0 0 0 0
  9865. -1.6631 1.4669 -1.2504 H 0 0 0 0 0 0 0 0 0 0 0 0
  9866. 2.3464 0.7343 -0.6607 H 0 0 0 0 0 0 0 0 0 0 0 0
  9867. 1.8678 -1.1175 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0
  9868. 1 2 2 0
  9869. 2 3 1 0
  9870. 3 4 2 0
  9871. 4 5 1 0
  9872. 5 6 2 0
  9873. 6 1 1 0
  9874. 1 7 1 0
  9875. 2 8 1 0
  9876. 3 9 1 0
  9877. 5 10 1 0
  9878. 6 11 1 0
  9879. M END
  9880. $$$$
  9881. RDKit 3D
  9882. 11 11 0 0 0 0 0 0 0 0999 V2000
  9883. -0.2702 -0.8751 0.7502 C 0 0 0 0 0 0 0 0 0 0 0 0
  9884. -1.2785 -0.1411 0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0
  9885. -0.9129 0.8735 -0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0
  9886. 0.3682 1.1925 -1.0223 N 0 0 0 0 0 0 0 0 0 0 0 0
  9887. 1.3253 0.4624 -0.4093 C 0 0 0 0 0 0 0 0 0 0 0 0
  9888. 1.0589 -0.5703 0.4755 C 0 0 0 0 0 0 0 0 0 0 0 0
  9889. -0.5180 -1.6779 1.4384 H 0 0 0 0 0 0 0 0 0 0 0 0
  9890. -2.3238 -0.3537 0.3273 H 0 0 0 0 0 0 0 0 0 0 0 0
  9891. -1.6631 1.4747 -1.2412 H 0 0 0 0 0 0 0 0 0 0 0 0
  9892. 2.3464 0.7384 -0.6561 H 0 0 0 0 0 0 0 0 0 0 0 0
  9893. 1.8678 -1.1234 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
  9894. 1 2 2 0
  9895. 2 3 1 0
  9896. 3 4 2 0
  9897. 4 5 1 0
  9898. 5 6 2 0
  9899. 6 1 1 0
  9900. 1 7 1 0
  9901. 2 8 1 0
  9902. 3 9 1 0
  9903. 5 10 1 0
  9904. 6 11 1 0
  9905. M END
  9906. $$$$
  9907. RDKit 3D
  9908. 11 11 0 0 0 0 0 0 0 0999 V2000
  9909. -0.2702 -0.8798 0.7447 C 0 0 0 0 0 0 0 0 0 0 0 0
  9910. -1.2785 -0.1419 0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
  9911. -0.9129 0.8781 -0.7304 C 0 0 0 0 0 0 0 0 0 0 0 0
  9912. 0.3682 1.1989 -1.0148 N 0 0 0 0 0 0 0 0 0 0 0 0
  9913. 1.3253 0.4650 -0.4064 C 0 0 0 0 0 0 0 0 0 0 0 0
  9914. 1.0589 -0.5733 0.4719 C 0 0 0 0 0 0 0 0 0 0 0 0
  9915. -0.5180 -1.6869 1.4279 H 0 0 0 0 0 0 0 0 0 0 0 0
  9916. -2.3238 -0.3557 0.3251 H 0 0 0 0 0 0 0 0 0 0 0 0
  9917. -1.6631 1.4825 -1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0
  9918. 2.3464 0.7425 -0.6514 H 0 0 0 0 0 0 0 0 0 0 0 0
  9919. 1.8678 -1.1293 0.9319 H 0 0 0 0 0 0 0 0 0 0 0 0
  9920. 1 2 2 0
  9921. 2 3 1 0
  9922. 3 4 2 0
  9923. 4 5 1 0
  9924. 5 6 2 0
  9925. 6 1 1 0
  9926. 1 7 1 0
  9927. 2 8 1 0
  9928. 3 9 1 0
  9929. 5 10 1 0
  9930. 6 11 1 0
  9931. M END
  9932. $$$$
  9933. RDKit 3D
  9934. 11 11 0 0 0 0 0 0 0 0999 V2000
  9935. -0.2702 -0.8844 0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0
  9936. -1.2785 -0.1428 0.1326 C 0 0 0 0 0 0 0 0 0 0 0 0
  9937. -0.9129 0.8826 -0.7249 C 0 0 0 0 0 0 0 0 0 0 0 0
  9938. 0.3682 1.2053 -1.0072 N 0 0 0 0 0 0 0 0 0 0 0 0
  9939. 1.3253 0.4675 -0.4035 C 0 0 0 0 0 0 0 0 0 0 0 0
  9940. 1.0589 -0.5763 0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0
  9941. -0.5180 -1.6959 1.4173 H 0 0 0 0 0 0 0 0 0 0 0 0
  9942. -2.3238 -0.3578 0.3228 H 0 0 0 0 0 0 0 0 0 0 0 0
  9943. -1.6631 1.4902 -1.2226 H 0 0 0 0 0 0 0 0 0 0 0 0
  9944. 2.3464 0.7466 -0.6468 H 0 0 0 0 0 0 0 0 0 0 0 0
  9945. 1.8678 -1.1351 0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0
  9946. 1 2 2 0
  9947. 2 3 1 0
  9948. 3 4 2 0
  9949. 4 5 1 0
  9950. 5 6 2 0
  9951. 6 1 1 0
  9952. 1 7 1 0
  9953. 2 8 1 0
  9954. 3 9 1 0
  9955. 5 10 1 0
  9956. 6 11 1 0
  9957. M END
  9958. $$$$
  9959. RDKit 3D
  9960. 11 11 0 0 0 0 0 0 0 0999 V2000
  9961. -0.2702 -0.8891 0.7336 C 0 0 0 0 0 0 0 0 0 0 0 0
  9962. -1.2785 -0.1436 0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0
  9963. -0.9129 0.8872 -0.7193 C 0 0 0 0 0 0 0 0 0 0 0 0
  9964. 0.3682 1.2116 -0.9997 N 0 0 0 0 0 0 0 0 0 0 0 0
  9965. 1.3253 0.4701 -0.4005 C 0 0 0 0 0 0 0 0 0 0 0 0
  9966. 1.0589 -0.5792 0.4647 C 0 0 0 0 0 0 0 0 0 0 0 0
  9967. -0.5180 -1.7047 1.4066 H 0 0 0 0 0 0 0 0 0 0 0 0
  9968. -2.3238 -0.3598 0.3206 H 0 0 0 0 0 0 0 0 0 0 0 0
  9969. -1.6631 1.4979 -1.2132 H 0 0 0 0 0 0 0 0 0 0 0 0
  9970. 2.3464 0.7506 -0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0
  9971. 1.8678 -1.1409 0.9176 H 0 0 0 0 0 0 0 0 0 0 0 0
  9972. 1 2 2 0
  9973. 2 3 1 0
  9974. 3 4 2 0
  9975. 4 5 1 0
  9976. 5 6 2 0
  9977. 6 1 1 0
  9978. 1 7 1 0
  9979. 2 8 1 0
  9980. 3 9 1 0
  9981. 5 10 1 0
  9982. 6 11 1 0
  9983. M END
  9984. $$$$
  9985. RDKit 3D
  9986. 11 11 0 0 0 0 0 0 0 0999 V2000
  9987. -0.2702 -0.8937 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0
  9988. -1.2785 -0.1444 0.1308 C 0 0 0 0 0 0 0 0 0 0 0 0
  9989. -0.9129 0.8917 -0.7137 C 0 0 0 0 0 0 0 0 0 0 0 0
  9990. 0.3682 1.2178 -0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0
  9991. 1.3253 0.4726 -0.3976 C 0 0 0 0 0 0 0 0 0 0 0 0
  9992. 1.0589 -0.5821 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0
  9993. -0.5180 -1.7135 1.3958 H 0 0 0 0 0 0 0 0 0 0 0 0
  9994. -2.3238 -0.3618 0.3183 H 0 0 0 0 0 0 0 0 0 0 0 0
  9995. -1.6631 1.5055 -1.2037 H 0 0 0 0 0 0 0 0 0 0 0 0
  9996. 2.3464 0.7547 -0.6373 H 0 0 0 0 0 0 0 0 0 0 0 0
  9997. 1.8678 -1.1467 0.9105 H 0 0 0 0 0 0 0 0 0 0 0 0
  9998. 1 2 2 0
  9999. 2 3 1 0
  10000. 3 4 2 0
  10001. 4 5 1 0
  10002. 5 6 2 0
  10003. 6 1 1 0
  10004. 1 7 1 0
  10005. 2 8 1 0
  10006. 3 9 1 0
  10007. 5 10 1 0
  10008. 6 11 1 0
  10009. M END
  10010. $$$$
  10011. RDKit 3D
  10012. 11 11 0 0 0 0 0 0 0 0999 V2000
  10013. -0.2702 -0.8982 0.7223 C 0 0 0 0 0 0 0 0 0 0 0 0
  10014. -1.2785 -0.1452 0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0
  10015. -0.9129 0.8961 -0.7081 C 0 0 0 0 0 0 0 0 0 0 0 0
  10016. 0.3682 1.2240 -0.9843 N 0 0 0 0 0 0 0 0 0 0 0 0
  10017. 1.3253 0.4751 -0.3946 C 0 0 0 0 0 0 0 0 0 0 0 0
  10018. 1.0589 -0.5850 0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0
  10019. -0.5180 -1.7223 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0
  10020. -2.3238 -0.3638 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
  10021. -1.6631 1.5130 -1.1943 H 0 0 0 0 0 0 0 0 0 0 0 0
  10022. 2.3464 0.7587 -0.6326 H 0 0 0 0 0 0 0 0 0 0 0 0
  10023. 1.8678 -1.1524 0.9032 H 0 0 0 0 0 0 0 0 0 0 0 0
  10024. 1 2 2 0
  10025. 2 3 1 0
  10026. 3 4 2 0
  10027. 4 5 1 0
  10028. 5 6 2 0
  10029. 6 1 1 0
  10030. 1 7 1 0
  10031. 2 8 1 0
  10032. 3 9 1 0
  10033. 5 10 1 0
  10034. 6 11 1 0
  10035. M END
  10036. $$$$
  10037. RDKit 3D
  10038. 11 11 0 0 0 0 0 0 0 0999 V2000
  10039. -0.2702 -0.9027 0.7167 C 0 0 0 0 0 0 0 0 0 0 0 0
  10040. -1.2785 -0.1461 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0
  10041. -0.9129 0.9006 -0.7025 C 0 0 0 0 0 0 0 0 0 0 0 0
  10042. 0.3682 1.2302 -0.9766 N 0 0 0 0 0 0 0 0 0 0 0 0
  10043. 1.3253 0.4775 -0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0
  10044. 1.0589 -0.5879 0.4537 C 0 0 0 0 0 0 0 0 0 0 0 0
  10045. -0.5180 -1.7309 1.3742 H 0 0 0 0 0 0 0 0 0 0 0 0
  10046. -2.3238 -0.3658 0.3138 H 0 0 0 0 0 0 0 0 0 0 0 0
  10047. -1.6631 1.5205 -1.1847 H 0 0 0 0 0 0 0 0 0 0 0 0
  10048. 2.3464 0.7626 -0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0
  10049. 1.8678 -1.1580 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  10050. 1 2 2 0
  10051. 2 3 1 0
  10052. 3 4 2 0
  10053. 4 5 1 0
  10054. 5 6 2 0
  10055. 6 1 1 0
  10056. 1 7 1 0
  10057. 2 8 1 0
  10058. 3 9 1 0
  10059. 5 10 1 0
  10060. 6 11 1 0
  10061. M END
  10062. $$$$
  10063. RDKit 3D
  10064. 11 11 0 0 0 0 0 0 0 0999 V2000
  10065. -0.2702 -0.9072 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0
  10066. -1.2785 -0.1469 0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0
  10067. -0.9129 0.9050 -0.6968 C 0 0 0 0 0 0 0 0 0 0 0 0
  10068. 0.3682 1.2363 -0.9689 N 0 0 0 0 0 0 0 0 0 0 0 0
  10069. 1.3253 0.4800 -0.3886 C 0 0 0 0 0 0 0 0 0 0 0 0
  10070. 1.0589 -0.5907 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0
  10071. -0.5180 -1.7395 1.3633 H 0 0 0 0 0 0 0 0 0 0 0 0
  10072. -2.3238 -0.3677 0.3115 H 0 0 0 0 0 0 0 0 0 0 0 0
  10073. -1.6631 1.5279 -1.1751 H 0 0 0 0 0 0 0 0 0 0 0 0
  10074. 2.3464 0.7665 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0
  10075. 1.8678 -1.1636 0.8887 H 0 0 0 0 0 0 0 0 0 0 0 0
  10076. 1 2 2 0
  10077. 2 3 1 0
  10078. 3 4 2 0
  10079. 4 5 1 0
  10080. 5 6 2 0
  10081. 6 1 1 0
  10082. 1 7 1 0
  10083. 2 8 1 0
  10084. 3 9 1 0
  10085. 5 10 1 0
  10086. 6 11 1 0
  10087. M END
  10088. $$$$
  10089. RDKit 3D
  10090. 11 11 0 0 0 0 0 0 0 0999 V2000
  10091. -0.2702 -0.9117 0.7053 C 0 0 0 0 0 0 0 0 0 0 0 0
  10092. -1.2785 -0.1477 0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0
  10093. -0.9129 0.9093 -0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0
  10094. 0.3682 1.2424 -0.9611 N 0 0 0 0 0 0 0 0 0 0 0 0
  10095. 1.3253 0.4824 -0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0
  10096. 1.0589 -0.5935 0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0
  10097. -0.5180 -1.7481 1.3523 H 0 0 0 0 0 0 0 0 0 0 0 0
  10098. -2.3238 -0.3697 0.3091 H 0 0 0 0 0 0 0 0 0 0 0 0
  10099. -1.6631 1.5352 -1.1655 H 0 0 0 0 0 0 0 0 0 0 0 0
  10100. 2.3464 0.7704 -0.6182 H 0 0 0 0 0 0 0 0 0 0 0 0
  10101. 1.8678 -1.1692 0.8813 H 0 0 0 0 0 0 0 0 0 0 0 0
  10102. 1 2 2 0
  10103. 2 3 1 0
  10104. 3 4 2 0
  10105. 4 5 1 0
  10106. 5 6 2 0
  10107. 6 1 1 0
  10108. 1 7 1 0
  10109. 2 8 1 0
  10110. 3 9 1 0
  10111. 5 10 1 0
  10112. 6 11 1 0
  10113. M END
  10114. $$$$
  10115. RDKit 3D
  10116. 11 11 0 0 0 0 0 0 0 0999 V2000
  10117. -0.2702 -0.9161 0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0
  10118. -1.2785 -0.1485 0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0
  10119. -0.9129 0.9137 -0.6854 C 0 0 0 0 0 0 0 0 0 0 0 0
  10120. 0.3682 1.2484 -0.9533 N 0 0 0 0 0 0 0 0 0 0 0 0
  10121. 1.3253 0.4848 -0.3825 C 0 0 0 0 0 0 0 0 0 0 0 0
  10122. 1.0589 -0.5963 0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0
  10123. -0.5180 -1.7565 1.3413 H 0 0 0 0 0 0 0 0 0 0 0 0
  10124. -2.3238 -0.3716 0.3068 H 0 0 0 0 0 0 0 0 0 0 0 0
  10125. -1.6631 1.5425 -1.1559 H 0 0 0 0 0 0 0 0 0 0 0 0
  10126. 2.3464 0.7743 -0.6133 H 0 0 0 0 0 0 0 0 0 0 0 0
  10127. 1.8678 -1.1747 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0
  10128. 1 2 2 0
  10129. 2 3 1 0
  10130. 3 4 2 0
  10131. 4 5 1 0
  10132. 5 6 2 0
  10133. 6 1 1 0
  10134. 1 7 1 0
  10135. 2 8 1 0
  10136. 3 9 1 0
  10137. 5 10 1 0
  10138. 6 11 1 0
  10139. M END
  10140. $$$$
  10141. RDKit 3D
  10142. 11 11 0 0 0 0 0 0 0 0999 V2000
  10143. -0.2702 -0.9205 0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0
  10144. -1.2785 -0.1492 0.1253 C 0 0 0 0 0 0 0 0 0 0 0 0
  10145. -0.9129 0.9179 -0.6796 C 0 0 0 0 0 0 0 0 0 0 0 0
  10146. 0.3682 1.2543 -0.9454 N 0 0 0 0 0 0 0 0 0 0 0 0
  10147. 1.3253 0.4872 -0.3795 C 0 0 0 0 0 0 0 0 0 0 0 0
  10148. 1.0589 -0.5991 0.4387 C 0 0 0 0 0 0 0 0 0 0 0 0
  10149. -0.5180 -1.7649 1.3303 H 0 0 0 0 0 0 0 0 0 0 0 0
  10150. -2.3238 -0.3735 0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0
  10151. -1.6631 1.5498 -1.1461 H 0 0 0 0 0 0 0 0 0 0 0 0
  10152. 2.3464 0.7782 -0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0
  10153. 1.8678 -1.1802 0.8666 H 0 0 0 0 0 0 0 0 0 0 0 0
  10154. 1 2 2 0
  10155. 2 3 1 0
  10156. 3 4 2 0
  10157. 4 5 1 0
  10158. 5 6 2 0
  10159. 6 1 1 0
  10160. 1 7 1 0
  10161. 2 8 1 0
  10162. 3 9 1 0
  10163. 5 10 1 0
  10164. 6 11 1 0
  10165. M END
  10166. $$$$
  10167. RDKit 3D
  10168. 11 11 0 0 0 0 0 0 0 0999 V2000
  10169. -0.2702 -0.9248 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
  10170. -1.2785 -0.1500 0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0
  10171. -0.9129 0.9222 -0.6738 C 0 0 0 0 0 0 0 0 0 0 0 0
  10172. 0.3682 1.2603 -0.9375 N 0 0 0 0 0 0 0 0 0 0 0 0
  10173. 1.3253 0.4896 -0.3764 C 0 0 0 0 0 0 0 0 0 0 0 0
  10174. 1.0589 -0.6018 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0
  10175. -0.5180 -1.7733 1.3191 H 0 0 0 0 0 0 0 0 0 0 0 0
  10176. -2.3238 -0.3754 0.3021 H 0 0 0 0 0 0 0 0 0 0 0 0
  10177. -1.6631 1.5569 -1.1364 H 0 0 0 0 0 0 0 0 0 0 0 0
  10178. 2.3464 0.7820 -0.6035 H 0 0 0 0 0 0 0 0 0 0 0 0
  10179. 1.8678 -1.1856 0.8592 H 0 0 0 0 0 0 0 0 0 0 0 0
  10180. 1 2 2 0
  10181. 2 3 1 0
  10182. 3 4 2 0
  10183. 4 5 1 0
  10184. 5 6 2 0
  10185. 6 1 1 0
  10186. 1 7 1 0
  10187. 2 8 1 0
  10188. 3 9 1 0
  10189. 5 10 1 0
  10190. 6 11 1 0
  10191. M END
  10192. $$$$
  10193. RDKit 3D
  10194. 11 11 0 0 0 0 0 0 0 0999 V2000
  10195. -0.2702 -0.9291 0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0
  10196. -1.2785 -0.1508 0.1234 C 0 0 0 0 0 0 0 0 0 0 0 0
  10197. -0.9129 0.9264 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0
  10198. 0.3682 1.2661 -0.9296 N 0 0 0 0 0 0 0 0 0 0 0 0
  10199. 1.3253 0.4920 -0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0
  10200. 1.0589 -0.6045 0.4312 C 0 0 0 0 0 0 0 0 0 0 0 0
  10201. -0.5180 -1.7815 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0
  10202. -2.3238 -0.3773 0.2997 H 0 0 0 0 0 0 0 0 0 0 0 0
  10203. -1.6631 1.5640 -1.1266 H 0 0 0 0 0 0 0 0 0 0 0 0
  10204. 2.3464 0.7857 -0.5986 H 0 0 0 0 0 0 0 0 0 0 0 0
  10205. 1.8678 -1.1910 0.8517 H 0 0 0 0 0 0 0 0 0 0 0 0
  10206. 1 2 2 0
  10207. 2 3 1 0
  10208. 3 4 2 0
  10209. 4 5 1 0
  10210. 5 6 2 0
  10211. 6 1 1 0
  10212. 1 7 1 0
  10213. 2 8 1 0
  10214. 3 9 1 0
  10215. 5 10 1 0
  10216. 6 11 1 0
  10217. M END
  10218. $$$$
  10219. RDKit 3D
  10220. 11 11 0 0 0 0 0 0 0 0999 V2000
  10221. -0.2702 -0.9334 0.6763 C 0 0 0 0 0 0 0 0 0 0 0 0
  10222. -1.2785 -0.1516 0.1224 C 0 0 0 0 0 0 0 0 0 0 0 0
  10223. -0.9129 0.9306 -0.6622 C 0 0 0 0 0 0 0 0 0 0 0 0
  10224. 0.3682 1.2719 -0.9216 N 0 0 0 0 0 0 0 0 0 0 0 0
  10225. 1.3253 0.4943 -0.3702 C 0 0 0 0 0 0 0 0 0 0 0 0
  10226. 1.0589 -0.6072 0.4274 C 0 0 0 0 0 0 0 0 0 0 0 0
  10227. -0.5180 -1.7897 1.2968 H 0 0 0 0 0 0 0 0 0 0 0 0
  10228. -2.3238 -0.3792 0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0
  10229. -1.6631 1.5711 -1.1167 H 0 0 0 0 0 0 0 0 0 0 0 0
  10230. 2.3464 0.7895 -0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0
  10231. 1.8678 -1.1963 0.8442 H 0 0 0 0 0 0 0 0 0 0 0 0
  10232. 1 2 2 0
  10233. 2 3 1 0
  10234. 3 4 2 0
  10235. 4 5 1 0
  10236. 5 6 2 0
  10237. 6 1 1 0
  10238. 1 7 1 0
  10239. 2 8 1 0
  10240. 3 9 1 0
  10241. 5 10 1 0
  10242. 6 11 1 0
  10243. M END
  10244. $$$$
  10245. RDKit 3D
  10246. 11 11 0 0 0 0 0 0 0 0999 V2000
  10247. -0.2702 -0.9376 0.6704 C 0 0 0 0 0 0 0 0 0 0 0 0
  10248. -1.2785 -0.1523 0.1215 C 0 0 0 0 0 0 0 0 0 0 0 0
  10249. -0.9129 0.9347 -0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0
  10250. 0.3682 1.2777 -0.9136 N 0 0 0 0 0 0 0 0 0 0 0 0
  10251. 1.3253 0.4966 -0.3671 C 0 0 0 0 0 0 0 0 0 0 0 0
  10252. 1.0589 -0.6099 0.4235 C 0 0 0 0 0 0 0 0 0 0 0 0
  10253. -0.5180 -1.7978 1.2855 H 0 0 0 0 0 0 0 0 0 0 0 0
  10254. -2.3238 -0.3811 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  10255. -1.6631 1.5781 -1.1068 H 0 0 0 0 0 0 0 0 0 0 0 0
  10256. 2.3464 0.7932 -0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0
  10257. 1.8678 -1.2016 0.8367 H 0 0 0 0 0 0 0 0 0 0 0 0
  10258. 1 2 2 0
  10259. 2 3 1 0
  10260. 3 4 2 0
  10261. 4 5 1 0
  10262. 5 6 2 0
  10263. 6 1 1 0
  10264. 1 7 1 0
  10265. 2 8 1 0
  10266. 3 9 1 0
  10267. 5 10 1 0
  10268. 6 11 1 0
  10269. M END
  10270. $$$$
  10271. RDKit 3D
  10272. 11 11 0 0 0 0 0 0 0 0999 V2000
  10273. -0.2702 -0.9418 0.6645 C 0 0 0 0 0 0 0 0 0 0 0 0
  10274. -1.2785 -0.1531 0.1205 C 0 0 0 0 0 0 0 0 0 0 0 0
  10275. -0.9129 0.9388 -0.6505 C 0 0 0 0 0 0 0 0 0 0 0 0
  10276. 0.3682 1.2834 -0.9055 N 0 0 0 0 0 0 0 0 0 0 0 0
  10277. 1.3253 0.4989 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
  10278. 1.0589 -0.6126 0.4197 C 0 0 0 0 0 0 0 0 0 0 0 0
  10279. -0.5180 -1.8058 1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0
  10280. -2.3238 -0.3829 0.2926 H 0 0 0 0 0 0 0 0 0 0 0 0
  10281. -1.6631 1.5850 -1.0969 H 0 0 0 0 0 0 0 0 0 0 0 0
  10282. 2.3464 0.7969 -0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0
  10283. 1.8678 -1.2068 0.8291 H 0 0 0 0 0 0 0 0 0 0 0 0
  10284. 1 2 2 0
  10285. 2 3 1 0
  10286. 3 4 2 0
  10287. 4 5 1 0
  10288. 5 6 2 0
  10289. 6 1 1 0
  10290. 1 7 1 0
  10291. 2 8 1 0
  10292. 3 9 1 0
  10293. 5 10 1 0
  10294. 6 11 1 0
  10295. M END
  10296. $$$$
  10297. RDKit 3D
  10298. 11 11 0 0 0 0 0 0 0 0999 V2000
  10299. -0.2702 -0.9460 0.6586 C 0 0 0 0 0 0 0 0 0 0 0 0
  10300. -1.2785 -0.1539 0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0
  10301. -0.9129 0.9429 -0.6445 C 0 0 0 0 0 0 0 0 0 0 0 0
  10302. 0.3682 1.2891 -0.8975 N 0 0 0 0 0 0 0 0 0 0 0 0
  10303. 1.3253 0.5012 -0.3608 C 0 0 0 0 0 0 0 0 0 0 0 0
  10304. 1.0589 -0.6152 0.4158 C 0 0 0 0 0 0 0 0 0 0 0 0
  10305. -0.5180 -1.8138 1.2628 H 0 0 0 0 0 0 0 0 0 0 0 0
  10306. -2.3238 -0.3847 0.2902 H 0 0 0 0 0 0 0 0 0 0 0 0
  10307. -1.6631 1.5919 -1.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
  10308. 2.3464 0.8005 -0.5787 H 0 0 0 0 0 0 0 0 0 0 0 0
  10309. 1.8678 -1.2120 0.8215 H 0 0 0 0 0 0 0 0 0 0 0 0
  10310. 1 2 2 0
  10311. 2 3 1 0
  10312. 3 4 2 0
  10313. 4 5 1 0
  10314. 5 6 2 0
  10315. 6 1 1 0
  10316. 1 7 1 0
  10317. 2 8 1 0
  10318. 3 9 1 0
  10319. 5 10 1 0
  10320. 6 11 1 0
  10321. M END
  10322. $$$$
  10323. RDKit 3D
  10324. 11 11 0 0 0 0 0 0 0 0999 V2000
  10325. -0.2702 -0.9501 0.6526 C 0 0 0 0 0 0 0 0 0 0 0 0
  10326. -1.2785 -0.1546 0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0
  10327. -0.9129 0.9469 -0.6386 C 0 0 0 0 0 0 0 0 0 0 0 0
  10328. 0.3682 1.2947 -0.8893 N 0 0 0 0 0 0 0 0 0 0 0 0
  10329. 1.3253 0.5034 -0.3577 C 0 0 0 0 0 0 0 0 0 0 0 0
  10330. 1.0589 -0.6178 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0
  10331. -0.5180 -1.8217 1.2514 H 0 0 0 0 0 0 0 0 0 0 0 0
  10332. -2.3238 -0.3866 0.2877 H 0 0 0 0 0 0 0 0 0 0 0 0
  10333. -1.6631 1.5987 -1.0769 H 0 0 0 0 0 0 0 0 0 0 0 0
  10334. 2.3464 0.8042 -0.5736 H 0 0 0 0 0 0 0 0 0 0 0 0
  10335. 1.8678 -1.2171 0.8139 H 0 0 0 0 0 0 0 0 0 0 0 0
  10336. 1 2 2 0
  10337. 2 3 1 0
  10338. 3 4 2 0
  10339. 4 5 1 0
  10340. 5 6 2 0
  10341. 6 1 1 0
  10342. 1 7 1 0
  10343. 2 8 1 0
  10344. 3 9 1 0
  10345. 5 10 1 0
  10346. 6 11 1 0
  10347. M END
  10348. $$$$
  10349. RDKit 3D
  10350. 11 11 0 0 0 0 0 0 0 0999 V2000
  10351. -0.2702 -0.9542 0.6466 C 0 0 0 0 0 0 0 0 0 0 0 0
  10352. -1.2785 -0.1554 0.1176 C 0 0 0 0 0 0 0 0 0 0 0 0
  10353. -0.9129 0.9509 -0.6326 C 0 0 0 0 0 0 0 0 0 0 0 0
  10354. 0.3682 1.3003 -0.8812 N 0 0 0 0 0 0 0 0 0 0 0 0
  10355. 1.3253 0.5057 -0.3545 C 0 0 0 0 0 0 0 0 0 0 0 0
  10356. 1.0589 -0.6204 0.4081 C 0 0 0 0 0 0 0 0 0 0 0 0
  10357. -0.5180 -1.8295 1.2399 H 0 0 0 0 0 0 0 0 0 0 0 0
  10358. -2.3238 -0.3884 0.2853 H 0 0 0 0 0 0 0 0 0 0 0 0
  10359. -1.6631 1.6054 -1.0668 H 0 0 0 0 0 0 0 0 0 0 0 0
  10360. 2.3464 0.8077 -0.5686 H 0 0 0 0 0 0 0 0 0 0 0 0
  10361. 1.8678 -1.2222 0.8062 H 0 0 0 0 0 0 0 0 0 0 0 0
  10362. 1 2 2 0
  10363. 2 3 1 0
  10364. 3 4 2 0
  10365. 4 5 1 0
  10366. 5 6 2 0
  10367. 6 1 1 0
  10368. 1 7 1 0
  10369. 2 8 1 0
  10370. 3 9 1 0
  10371. 5 10 1 0
  10372. 6 11 1 0
  10373. M END
  10374. $$$$
  10375. RDKit 3D
  10376. 11 11 0 0 0 0 0 0 0 0999 V2000
  10377. -0.2702 -0.9582 0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0
  10378. -1.2785 -0.1561 0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0
  10379. -0.9129 0.9549 -0.6267 C 0 0 0 0 0 0 0 0 0 0 0 0
  10380. 0.3682 1.3058 -0.8730 N 0 0 0 0 0 0 0 0 0 0 0 0
  10381. 1.3253 0.5079 -0.3513 C 0 0 0 0 0 0 0 0 0 0 0 0
  10382. 1.0589 -0.6229 0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0
  10383. -0.5180 -1.8373 1.2284 H 0 0 0 0 0 0 0 0 0 0 0 0
  10384. -2.3238 -0.3901 0.2829 H 0 0 0 0 0 0 0 0 0 0 0 0
  10385. -1.6631 1.6121 -1.0567 H 0 0 0 0 0 0 0 0 0 0 0 0
  10386. 2.3464 0.8113 -0.5635 H 0 0 0 0 0 0 0 0 0 0 0 0
  10387. 1.8678 -1.2273 0.7985 H 0 0 0 0 0 0 0 0 0 0 0 0
  10388. 1 2 2 0
  10389. 2 3 1 0
  10390. 3 4 2 0
  10391. 4 5 1 0
  10392. 5 6 2 0
  10393. 6 1 1 0
  10394. 1 7 1 0
  10395. 2 8 1 0
  10396. 3 9 1 0
  10397. 5 10 1 0
  10398. 6 11 1 0
  10399. M END
  10400. $$$$
  10401. RDKit 3D
  10402. 11 11 0 0 0 0 0 0 0 0999 V2000
  10403. -0.2702 -0.9622 0.6346 C 0 0 0 0 0 0 0 0 0 0 0 0
  10404. -1.2785 -0.1568 0.1157 C 0 0 0 0 0 0 0 0 0 0 0 0
  10405. -0.9129 0.9588 -0.6206 C 0 0 0 0 0 0 0 0 0 0 0 0
  10406. 0.3682 1.3112 -0.8648 N 0 0 0 0 0 0 0 0 0 0 0 0
  10407. 1.3253 0.5101 -0.3481 C 0 0 0 0 0 0 0 0 0 0 0 0
  10408. 1.0589 -0.6254 0.4003 C 0 0 0 0 0 0 0 0 0 0 0 0
  10409. -0.5180 -1.8450 1.2168 H 0 0 0 0 0 0 0 0 0 0 0 0
  10410. -2.3238 -0.3919 0.2804 H 0 0 0 0 0 0 0 0 0 0 0 0
  10411. -1.6631 1.6187 -1.0466 H 0 0 0 0 0 0 0 0 0 0 0 0
  10412. 2.3464 0.8148 -0.5584 H 0 0 0 0 0 0 0 0 0 0 0 0
  10413. 1.8678 -1.2323 0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0
  10414. 1 2 2 0
  10415. 2 3 1 0
  10416. 3 4 2 0
  10417. 4 5 1 0
  10418. 5 6 2 0
  10419. 6 1 1 0
  10420. 1 7 1 0
  10421. 2 8 1 0
  10422. 3 9 1 0
  10423. 5 10 1 0
  10424. 6 11 1 0
  10425. M END
  10426. $$$$
  10427. RDKit 3D
  10428. 11 11 0 0 0 0 0 0 0 0999 V2000
  10429. -0.2702 -0.9662 0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0
  10430. -1.2785 -0.1575 0.1147 C 0 0 0 0 0 0 0 0 0 0 0 0
  10431. -0.9129 0.9627 -0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0
  10432. 0.3682 1.3166 -0.8565 N 0 0 0 0 0 0 0 0 0 0 0 0
  10433. 1.3253 0.5123 -0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0
  10434. 1.0589 -0.6279 0.3963 C 0 0 0 0 0 0 0 0 0 0 0 0
  10435. -0.5180 -1.8526 1.2052 H 0 0 0 0 0 0 0 0 0 0 0 0
  10436. -2.3238 -0.3937 0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
  10437. -1.6631 1.6252 -1.0364 H 0 0 0 0 0 0 0 0 0 0 0 0
  10438. 2.3464 0.8183 -0.5532 H 0 0 0 0 0 0 0 0 0 0 0 0
  10439. 1.8678 -1.2372 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0
  10440. 1 2 2 0
  10441. 2 3 1 0
  10442. 3 4 2 0
  10443. 4 5 1 0
  10444. 5 6 2 0
  10445. 6 1 1 0
  10446. 1 7 1 0
  10447. 2 8 1 0
  10448. 3 9 1 0
  10449. 5 10 1 0
  10450. 6 11 1 0
  10451. M END
  10452. $$$$
  10453. RDKit 3D
  10454. 11 11 0 0 0 0 0 0 0 0999 V2000
  10455. -0.2702 -0.9701 0.6225 C 0 0 0 0 0 0 0 0 0 0 0 0
  10456. -1.2785 -0.1583 0.1137 C 0 0 0 0 0 0 0 0 0 0 0 0
  10457. -0.9129 0.9665 -0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0
  10458. 0.3682 1.3220 -0.8482 N 0 0 0 0 0 0 0 0 0 0 0 0
  10459. 1.3253 0.5144 -0.3417 C 0 0 0 0 0 0 0 0 0 0 0 0
  10460. 1.0589 -0.6304 0.3924 C 0 0 0 0 0 0 0 0 0 0 0 0
  10461. -0.5180 -1.8601 1.1935 H 0 0 0 0 0 0 0 0 0 0 0 0
  10462. -2.3238 -0.3954 0.2755 H 0 0 0 0 0 0 0 0 0 0 0 0
  10463. -1.6631 1.6317 -1.0261 H 0 0 0 0 0 0 0 0 0 0 0 0
  10464. 2.3464 0.8218 -0.5481 H 0 0 0 0 0 0 0 0 0 0 0 0
  10465. 1.8678 -1.2421 0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0
  10466. 1 2 2 0
  10467. 2 3 1 0
  10468. 3 4 2 0
  10469. 4 5 1 0
  10470. 5 6 2 0
  10471. 6 1 1 0
  10472. 1 7 1 0
  10473. 2 8 1 0
  10474. 3 9 1 0
  10475. 5 10 1 0
  10476. 6 11 1 0
  10477. M END
  10478. $$$$
  10479. RDKit 3D
  10480. 11 11 0 0 0 0 0 0 0 0999 V2000
  10481. -0.2702 -0.9740 0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0
  10482. -1.2785 -0.1590 0.1127 C 0 0 0 0 0 0 0 0 0 0 0 0
  10483. -0.9129 0.9703 -0.6025 C 0 0 0 0 0 0 0 0 0 0 0 0
  10484. 0.3682 1.3273 -0.8399 N 0 0 0 0 0 0 0 0 0 0 0 0
  10485. 1.3253 0.5166 -0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0
  10486. 1.0589 -0.6329 0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0
  10487. -0.5180 -1.8676 1.1818 H 0 0 0 0 0 0 0 0 0 0 0 0
  10488. -2.3238 -0.3971 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0
  10489. -1.6631 1.6381 -1.0159 H 0 0 0 0 0 0 0 0 0 0 0 0
  10490. 2.3464 0.8252 -0.5429 H 0 0 0 0 0 0 0 0 0 0 0 0
  10491. 1.8678 -1.2469 0.7674 H 0 0 0 0 0 0 0 0 0 0 0 0
  10492. 1 2 2 0
  10493. 2 3 1 0
  10494. 3 4 2 0
  10495. 4 5 1 0
  10496. 5 6 2 0
  10497. 6 1 1 0
  10498. 1 7 1 0
  10499. 2 8 1 0
  10500. 3 9 1 0
  10501. 5 10 1 0
  10502. 6 11 1 0
  10503. M END
  10504. $$$$
  10505. RDKit 3D
  10506. 11 11 0 0 0 0 0 0 0 0999 V2000
  10507. -0.2702 -0.9779 0.6102 C 0 0 0 0 0 0 0 0 0 0 0 0
  10508. -1.2785 -0.1597 0.1117 C 0 0 0 0 0 0 0 0 0 0 0 0
  10509. -0.9129 0.9741 -0.5964 C 0 0 0 0 0 0 0 0 0 0 0 0
  10510. 0.3682 1.3325 -0.8316 N 0 0 0 0 0 0 0 0 0 0 0 0
  10511. 1.3253 0.5187 -0.3352 C 0 0 0 0 0 0 0 0 0 0 0 0
  10512. 1.0589 -0.6353 0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0
  10513. -0.5180 -1.8750 1.1701 H 0 0 0 0 0 0 0 0 0 0 0 0
  10514. -2.3238 -0.3988 0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0
  10515. -1.6631 1.6445 -1.0056 H 0 0 0 0 0 0 0 0 0 0 0 0
  10516. 2.3464 0.8286 -0.5377 H 0 0 0 0 0 0 0 0 0 0 0 0
  10517. 1.8678 -1.2517 0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0
  10518. 1 2 2 0
  10519. 2 3 1 0
  10520. 3 4 2 0
  10521. 4 5 1 0
  10522. 5 6 2 0
  10523. 6 1 1 0
  10524. 1 7 1 0
  10525. 2 8 1 0
  10526. 3 9 1 0
  10527. 5 10 1 0
  10528. 6 11 1 0
  10529. M END
  10530. $$$$
  10531. RDKit 3D
  10532. 11 11 0 0 0 0 0 0 0 0999 V2000
  10533. -0.2702 -0.9817 0.6041 C 0 0 0 0 0 0 0 0 0 0 0 0
  10534. -1.2785 -0.1604 0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
  10535. -0.9129 0.9778 -0.5902 C 0 0 0 0 0 0 0 0 0 0 0 0
  10536. 0.3682 1.3377 -0.8232 N 0 0 0 0 0 0 0 0 0 0 0 0
  10537. 1.3253 0.5208 -0.3319 C 0 0 0 0 0 0 0 0 0 0 0 0
  10538. 1.0589 -0.6377 0.3804 C 0 0 0 0 0 0 0 0 0 0 0 0
  10539. -0.5180 -1.8823 1.1583 H 0 0 0 0 0 0 0 0 0 0 0 0
  10540. -2.3238 -0.4005 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0
  10541. -1.6631 1.6507 -0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0
  10542. 2.3464 0.8320 -0.5325 H 0 0 0 0 0 0 0 0 0 0 0 0
  10543. 1.8678 -1.2565 0.7517 H 0 0 0 0 0 0 0 0 0 0 0 0
  10544. 1 2 2 0
  10545. 2 3 1 0
  10546. 3 4 2 0
  10547. 4 5 1 0
  10548. 5 6 2 0
  10549. 6 1 1 0
  10550. 1 7 1 0
  10551. 2 8 1 0
  10552. 3 9 1 0
  10553. 5 10 1 0
  10554. 6 11 1 0
  10555. M END
  10556. $$$$
  10557. RDKit 3D
  10558. 11 11 0 0 0 0 0 0 0 0999 V2000
  10559. -0.2702 -0.9855 0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0
  10560. -1.2785 -0.1611 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0
  10561. -0.9129 0.9815 -0.5841 C 0 0 0 0 0 0 0 0 0 0 0 0
  10562. 0.3682 1.3429 -0.8148 N 0 0 0 0 0 0 0 0 0 0 0 0
  10563. 1.3253 0.5228 -0.3287 C 0 0 0 0 0 0 0 0 0 0 0 0
  10564. 1.0589 -0.6401 0.3764 C 0 0 0 0 0 0 0 0 0 0 0 0
  10565. -0.5180 -1.8895 1.1464 H 0 0 0 0 0 0 0 0 0 0 0 0
  10566. -2.3238 -0.4022 0.2654 H 0 0 0 0 0 0 0 0 0 0 0 0
  10567. -1.6631 1.6570 -0.9848 H 0 0 0 0 0 0 0 0 0 0 0 0
  10568. 2.3464 0.8353 -0.5273 H 0 0 0 0 0 0 0 0 0 0 0 0
  10569. 1.8678 -1.2612 0.7438 H 0 0 0 0 0 0 0 0 0 0 0 0
  10570. 1 2 2 0
  10571. 2 3 1 0
  10572. 3 4 2 0
  10573. 4 5 1 0
  10574. 5 6 2 0
  10575. 6 1 1 0
  10576. 1 7 1 0
  10577. 2 8 1 0
  10578. 3 9 1 0
  10579. 5 10 1 0
  10580. 6 11 1 0
  10581. M END
  10582. $$$$
  10583. RDKit 3D
  10584. 11 11 0 0 0 0 0 0 0 0999 V2000
  10585. -0.2702 -0.9892 0.5917 C 0 0 0 0 0 0 0 0 0 0 0 0
  10586. -1.2785 -0.1618 0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0
  10587. -0.9129 0.9852 -0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0
  10588. 0.3682 1.3480 -0.8063 N 0 0 0 0 0 0 0 0 0 0 0 0
  10589. 1.3253 0.5249 -0.3254 C 0 0 0 0 0 0 0 0 0 0 0 0
  10590. 1.0589 -0.6424 0.3724 C 0 0 0 0 0 0 0 0 0 0 0 0
  10591. -0.5180 -1.8967 1.1345 H 0 0 0 0 0 0 0 0 0 0 0 0
  10592. -2.3238 -0.4039 0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0
  10593. -1.6631 1.6631 -0.9744 H 0 0 0 0 0 0 0 0 0 0 0 0
  10594. 2.3464 0.8386 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  10595. 1.8678 -1.2658 0.7358 H 0 0 0 0 0 0 0 0 0 0 0 0
  10596. 1 2 2 0
  10597. 2 3 1 0
  10598. 3 4 2 0
  10599. 4 5 1 0
  10600. 5 6 2 0
  10601. 6 1 1 0
  10602. 1 7 1 0
  10603. 2 8 1 0
  10604. 3 9 1 0
  10605. 5 10 1 0
  10606. 6 11 1 0
  10607. M END
  10608. $$$$
  10609. RDKit 3D
  10610. 11 11 0 0 0 0 0 0 0 0999 V2000
  10611. -0.2702 -0.9929 0.5855 C 0 0 0 0 0 0 0 0 0 0 0 0
  10612. -1.2785 -0.1624 0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0
  10613. -0.9129 0.9888 -0.5717 C 0 0 0 0 0 0 0 0 0 0 0 0
  10614. 0.3682 1.3530 -0.7978 N 0 0 0 0 0 0 0 0 0 0 0 0
  10615. 1.3253 0.5269 -0.3221 C 0 0 0 0 0 0 0 0 0 0 0 0
  10616. 1.0589 -0.6448 0.3683 C 0 0 0 0 0 0 0 0 0 0 0 0
  10617. -0.5180 -1.9038 1.1226 H 0 0 0 0 0 0 0 0 0 0 0 0
  10618. -2.3238 -0.4055 0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0
  10619. -1.6631 1.6692 -0.9639 H 0 0 0 0 0 0 0 0 0 0 0 0
  10620. 2.3464 0.8418 -0.5167 H 0 0 0 0 0 0 0 0 0 0 0 0
  10621. 1.8678 -1.2704 0.7279 H 0 0 0 0 0 0 0 0 0 0 0 0
  10622. 1 2 2 0
  10623. 2 3 1 0
  10624. 3 4 2 0
  10625. 4 5 1 0
  10626. 5 6 2 0
  10627. 6 1 1 0
  10628. 1 7 1 0
  10629. 2 8 1 0
  10630. 3 9 1 0
  10631. 5 10 1 0
  10632. 6 11 1 0
  10633. M END
  10634. $$$$
  10635. RDKit 3D
  10636. 11 11 0 0 0 0 0 0 0 0999 V2000
  10637. -0.2702 -0.9965 0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0
  10638. -1.2785 -0.1631 0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0
  10639. -0.9129 0.9924 -0.5655 C 0 0 0 0 0 0 0 0 0 0 0 0
  10640. 0.3682 1.3580 -0.7893 N 0 0 0 0 0 0 0 0 0 0 0 0
  10641. 1.3253 0.5289 -0.3187 C 0 0 0 0 0 0 0 0 0 0 0 0
  10642. 1.0589 -0.6471 0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0
  10643. -0.5180 -1.9108 1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0
  10644. -2.3238 -0.4071 0.2578 H 0 0 0 0 0 0 0 0 0 0 0 0
  10645. -1.6631 1.6752 -0.9534 H 0 0 0 0 0 0 0 0 0 0 0 0
  10646. 2.3464 0.8451 -0.5114 H 0 0 0 0 0 0 0 0 0 0 0 0
  10647. 1.8678 -1.2750 0.7199 H 0 0 0 0 0 0 0 0 0 0 0 0
  10648. 1 2 2 0
  10649. 2 3 1 0
  10650. 3 4 2 0
  10651. 4 5 1 0
  10652. 5 6 2 0
  10653. 6 1 1 0
  10654. 1 7 1 0
  10655. 2 8 1 0
  10656. 3 9 1 0
  10657. 5 10 1 0
  10658. 6 11 1 0
  10659. M END
  10660. $$$$
  10661. RDKit 3D
  10662. 11 11 0 0 0 0 0 0 0 0999 V2000
  10663. -0.2702 -1.0002 0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0
  10664. -1.2785 -0.1638 0.1056 C 0 0 0 0 0 0 0 0 0 0 0 0
  10665. -0.9129 0.9959 -0.5592 C 0 0 0 0 0 0 0 0 0 0 0 0
  10666. 0.3682 1.3629 -0.7807 N 0 0 0 0 0 0 0 0 0 0 0 0
  10667. 1.3253 0.5309 -0.3154 C 0 0 0 0 0 0 0 0 0 0 0 0
  10668. 1.0589 -0.6493 0.3602 C 0 0 0 0 0 0 0 0 0 0 0 0
  10669. -0.5180 -1.9177 1.0986 H 0 0 0 0 0 0 0 0 0 0 0 0
  10670. -2.3238 -0.4088 0.2552 H 0 0 0 0 0 0 0 0 0 0 0 0
  10671. -1.6631 1.6812 -0.9429 H 0 0 0 0 0 0 0 0 0 0 0 0
  10672. 2.3464 0.8483 -0.5061 H 0 0 0 0 0 0 0 0 0 0 0 0
  10673. 1.8678 -1.2795 0.7118 H 0 0 0 0 0 0 0 0 0 0 0 0
  10674. 1 2 2 0
  10675. 2 3 1 0
  10676. 3 4 2 0
  10677. 4 5 1 0
  10678. 5 6 2 0
  10679. 6 1 1 0
  10680. 1 7 1 0
  10681. 2 8 1 0
  10682. 3 9 1 0
  10683. 5 10 1 0
  10684. 6 11 1 0
  10685. M END
  10686. $$$$
  10687. RDKit 3D
  10688. 11 11 0 0 0 0 0 0 0 0999 V2000
  10689. -0.2702 -1.0037 0.5666 C 0 0 0 0 0 0 0 0 0 0 0 0
  10690. -1.2785 -0.1644 0.1045 C 0 0 0 0 0 0 0 0 0 0 0 0
  10691. -0.9129 0.9994 -0.5529 C 0 0 0 0 0 0 0 0 0 0 0 0
  10692. 0.3682 1.3678 -0.7722 N 0 0 0 0 0 0 0 0 0 0 0 0
  10693. 1.3253 0.5329 -0.3121 C 0 0 0 0 0 0 0 0 0 0 0 0
  10694. 1.0589 -0.6516 0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0
  10695. -0.5180 -1.9246 1.0865 H 0 0 0 0 0 0 0 0 0 0 0 0
  10696. -2.3238 -0.4103 0.2527 H 0 0 0 0 0 0 0 0 0 0 0 0
  10697. -1.6631 1.6871 -0.9323 H 0 0 0 0 0 0 0 0 0 0 0 0
  10698. 2.3464 0.8514 -0.5008 H 0 0 0 0 0 0 0 0 0 0 0 0
  10699. 1.8678 -1.2839 0.7038 H 0 0 0 0 0 0 0 0 0 0 0 0
  10700. 1 2 2 0
  10701. 2 3 1 0
  10702. 3 4 2 0
  10703. 4 5 1 0
  10704. 5 6 2 0
  10705. 6 1 1 0
  10706. 1 7 1 0
  10707. 2 8 1 0
  10708. 3 9 1 0
  10709. 5 10 1 0
  10710. 6 11 1 0
  10711. M END
  10712. $$$$
  10713. RDKit 3D
  10714. 11 11 0 0 0 0 0 0 0 0999 V2000
  10715. -0.2702 -1.0073 0.5603 C 0 0 0 0 0 0 0 0 0 0 0 0
  10716. -1.2785 -0.1651 0.1035 C 0 0 0 0 0 0 0 0 0 0 0 0
  10717. -0.9129 1.0028 -0.5467 C 0 0 0 0 0 0 0 0 0 0 0 0
  10718. 0.3682 1.3726 -0.7636 N 0 0 0 0 0 0 0 0 0 0 0 0
  10719. 1.3253 0.5349 -0.3087 C 0 0 0 0 0 0 0 0 0 0 0 0
  10720. 1.0589 -0.6538 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0
  10721. -0.5180 -1.9314 1.0744 H 0 0 0 0 0 0 0 0 0 0 0 0
  10722. -2.3238 -0.4119 0.2501 H 0 0 0 0 0 0 0 0 0 0 0 0
  10723. -1.6631 1.6929 -0.9217 H 0 0 0 0 0 0 0 0 0 0 0 0
  10724. 2.3464 0.8546 -0.4954 H 0 0 0 0 0 0 0 0 0 0 0 0
  10725. 1.8678 -1.2883 0.6957 H 0 0 0 0 0 0 0 0 0 0 0 0
  10726. 1 2 2 0
  10727. 2 3 1 0
  10728. 3 4 2 0
  10729. 4 5 1 0
  10730. 5 6 2 0
  10731. 6 1 1 0
  10732. 1 7 1 0
  10733. 2 8 1 0
  10734. 3 9 1 0
  10735. 5 10 1 0
  10736. 6 11 1 0
  10737. M END
  10738. $$$$
  10739. RDKit 3D
  10740. 11 11 0 0 0 0 0 0 0 0999 V2000
  10741. -0.2702 -1.0108 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0
  10742. -1.2785 -0.1657 0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0
  10743. -0.9129 1.0063 -0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0
  10744. 0.3682 1.3774 -0.7549 N 0 0 0 0 0 0 0 0 0 0 0 0
  10745. 1.3253 0.5368 -0.3053 C 0 0 0 0 0 0 0 0 0 0 0 0
  10746. 1.0589 -0.6560 0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0
  10747. -0.5180 -1.9381 1.0622 H 0 0 0 0 0 0 0 0 0 0 0 0
  10748. -2.3238 -0.4135 0.2475 H 0 0 0 0 0 0 0 0 0 0 0 0
  10749. -1.6631 1.6987 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0
  10750. 2.3464 0.8577 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0
  10751. 1.8678 -1.2927 0.6876 H 0 0 0 0 0 0 0 0 0 0 0 0
  10752. 1 2 2 0
  10753. 2 3 1 0
  10754. 3 4 2 0
  10755. 4 5 1 0
  10756. 5 6 2 0
  10757. 6 1 1 0
  10758. 1 7 1 0
  10759. 2 8 1 0
  10760. 3 9 1 0
  10761. 5 10 1 0
  10762. 6 11 1 0
  10763. M END
  10764. $$$$
  10765. RDKit 3D
  10766. 11 11 0 0 0 0 0 0 0 0999 V2000
  10767. -0.2702 -1.0142 0.5476 C 0 0 0 0 0 0 0 0 0 0 0 0
  10768. -1.2785 -0.1664 0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0
  10769. -0.9129 1.0096 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0
  10770. 0.3682 1.3821 -0.7462 N 0 0 0 0 0 0 0 0 0 0 0 0
  10771. 1.3253 0.5387 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0
  10772. 1.0589 -0.6582 0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0
  10773. -0.5180 -1.9447 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0
  10774. -2.3238 -0.4150 0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0
  10775. -1.6631 1.7044 -0.9003 H 0 0 0 0 0 0 0 0 0 0 0 0
  10776. 2.3464 0.8607 -0.4846 H 0 0 0 0 0 0 0 0 0 0 0 0
  10777. 1.8678 -1.2970 0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0
  10778. 1 2 2 0
  10779. 2 3 1 0
  10780. 3 4 2 0
  10781. 4 5 1 0
  10782. 5 6 2 0
  10783. 6 1 1 0
  10784. 1 7 1 0
  10785. 2 8 1 0
  10786. 3 9 1 0
  10787. 5 10 1 0
  10788. 6 11 1 0
  10789. M END
  10790. $$$$
  10791. RDKit 3D
  10792. 11 11 0 0 0 0 0 0 0 0999 V2000
  10793. -0.2702 -1.0177 0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0
  10794. -1.2785 -0.1670 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0
  10795. -0.9129 1.0130 -0.5277 C 0 0 0 0 0 0 0 0 0 0 0 0
  10796. 0.3682 1.3868 -0.7376 N 0 0 0 0 0 0 0 0 0 0 0 0
  10797. 1.3253 0.5406 -0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0
  10798. 1.0589 -0.6603 0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0
  10799. -0.5180 -1.9513 1.0378 H 0 0 0 0 0 0 0 0 0 0 0 0
  10800. -2.3238 -0.4166 0.2423 H 0 0 0 0 0 0 0 0 0 0 0 0
  10801. -1.6631 1.7100 -0.8896 H 0 0 0 0 0 0 0 0 0 0 0 0
  10802. 2.3464 0.8638 -0.4792 H 0 0 0 0 0 0 0 0 0 0 0 0
  10803. 1.8678 -1.3012 0.6713 H 0 0 0 0 0 0 0 0 0 0 0 0
  10804. 1 2 2 0
  10805. 2 3 1 0
  10806. 3 4 2 0
  10807. 4 5 1 0
  10808. 5 6 2 0
  10809. 6 1 1 0
  10810. 1 7 1 0
  10811. 2 8 1 0
  10812. 3 9 1 0
  10813. 5 10 1 0
  10814. 6 11 1 0
  10815. M END
  10816. $$$$
  10817. RDKit 3D
  10818. 11 11 0 0 0 0 0 0 0 0999 V2000
  10819. -0.2702 -1.0210 0.5348 C 0 0 0 0 0 0 0 0 0 0 0 0
  10820. -1.2785 -0.1676 0.0993 C 0 0 0 0 0 0 0 0 0 0 0 0
  10821. -0.9129 1.0163 -0.5213 C 0 0 0 0 0 0 0 0 0 0 0 0
  10822. 0.3682 1.3914 -0.7288 N 0 0 0 0 0 0 0 0 0 0 0 0
  10823. 1.3253 0.5424 -0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0
  10824. 1.0589 -0.6624 0.3355 C 0 0 0 0 0 0 0 0 0 0 0 0
  10825. -0.5180 -1.9578 1.0255 H 0 0 0 0 0 0 0 0 0 0 0 0
  10826. -2.3238 -0.4181 0.2397 H 0 0 0 0 0 0 0 0 0 0 0 0
  10827. -1.6631 1.7155 -0.8788 H 0 0 0 0 0 0 0 0 0 0 0 0
  10828. 2.3464 0.8667 -0.4738 H 0 0 0 0 0 0 0 0 0 0 0 0
  10829. 1.8678 -1.3054 0.6631 H 0 0 0 0 0 0 0 0 0 0 0 0
  10830. 1 2 2 0
  10831. 2 3 1 0
  10832. 3 4 2 0
  10833. 4 5 1 0
  10834. 5 6 2 0
  10835. 6 1 1 0
  10836. 1 7 1 0
  10837. 2 8 1 0
  10838. 3 9 1 0
  10839. 5 10 1 0
  10840. 6 11 1 0
  10841. M END
  10842. $$$$
  10843. RDKit 3D
  10844. 11 11 0 0 0 0 0 0 0 0999 V2000
  10845. -0.2702 -1.0244 0.5284 C 0 0 0 0 0 0 0 0 0 0 0 0
  10846. -1.2785 -0.1683 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0
  10847. -0.9129 1.0195 -0.5149 C 0 0 0 0 0 0 0 0 0 0 0 0
  10848. 0.3682 1.3960 -0.7201 N 0 0 0 0 0 0 0 0 0 0 0 0
  10849. 1.3253 0.5443 -0.2918 C 0 0 0 0 0 0 0 0 0 0 0 0
  10850. 1.0589 -0.6645 0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0
  10851. -0.5180 -1.9642 1.0132 H 0 0 0 0 0 0 0 0 0 0 0 0
  10852. -2.3238 -0.4196 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0
  10853. -1.6631 1.7210 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0
  10854. 2.3464 0.8697 -0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0
  10855. 1.8678 -1.3095 0.6549 H 0 0 0 0 0 0 0 0 0 0 0 0
  10856. 1 2 2 0
  10857. 2 3 1 0
  10858. 3 4 2 0
  10859. 4 5 1 0
  10860. 5 6 2 0
  10861. 6 1 1 0
  10862. 1 7 1 0
  10863. 2 8 1 0
  10864. 3 9 1 0
  10865. 5 10 1 0
  10866. 6 11 1 0
  10867. M END
  10868. $$$$
  10869. RDKit 3D
  10870. 11 11 0 0 0 0 0 0 0 0999 V2000
  10871. -0.2702 -1.0277 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0
  10872. -1.2785 -0.1689 0.0972 C 0 0 0 0 0 0 0 0 0 0 0 0
  10873. -0.9129 1.0227 -0.5085 C 0 0 0 0 0 0 0 0 0 0 0 0
  10874. 0.3682 1.4005 -0.7113 N 0 0 0 0 0 0 0 0 0 0 0 0
  10875. 1.3253 0.5461 -0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0
  10876. 1.0589 -0.6666 0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0
  10877. -0.5180 -1.9705 1.0008 H 0 0 0 0 0 0 0 0 0 0 0 0
  10878. -2.3238 -0.4211 0.2344 H 0 0 0 0 0 0 0 0 0 0 0 0
  10879. -1.6631 1.7264 -0.8572 H 0 0 0 0 0 0 0 0 0 0 0 0
  10880. 2.3464 0.8726 -0.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
  10881. 1.8678 -1.3136 0.6467 H 0 0 0 0 0 0 0 0 0 0 0 0
  10882. 1 2 2 0
  10883. 2 3 1 0
  10884. 3 4 2 0
  10885. 4 5 1 0
  10886. 5 6 2 0
  10887. 6 1 1 0
  10888. 1 7 1 0
  10889. 2 8 1 0
  10890. 3 9 1 0
  10891. 5 10 1 0
  10892. 6 11 1 0
  10893. M END
  10894. $$$$
  10895. RDKit 3D
  10896. 11 11 0 0 0 0 0 0 0 0999 V2000
  10897. -0.2702 -1.0309 0.5155 C 0 0 0 0 0 0 0 0 0 0 0 0
  10898. -1.2785 -0.1695 0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0
  10899. -0.9129 1.0259 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0
  10900. 0.3682 1.4049 -0.7025 N 0 0 0 0 0 0 0 0 0 0 0 0
  10901. 1.3253 0.5479 -0.2849 C 0 0 0 0 0 0 0 0 0 0 0 0
  10902. 1.0589 -0.6687 0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0
  10903. -0.5180 -1.9768 0.9884 H 0 0 0 0 0 0 0 0 0 0 0 0
  10904. -2.3238 -0.4225 0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
  10905. -1.6631 1.7318 -0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0
  10906. 2.3464 0.8755 -0.4574 H 0 0 0 0 0 0 0 0 0 0 0 0
  10907. 1.8678 -1.3177 0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0
  10908. 1 2 2 0
  10909. 2 3 1 0
  10910. 3 4 2 0
  10911. 4 5 1 0
  10912. 5 6 2 0
  10913. 6 1 1 0
  10914. 1 7 1 0
  10915. 2 8 1 0
  10916. 3 9 1 0
  10917. 5 10 1 0
  10918. 6 11 1 0
  10919. M END
  10920. $$$$
  10921. RDKit 3D
  10922. 11 11 0 0 0 0 0 0 0 0999 V2000
  10923. -0.2702 -1.0342 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0
  10924. -1.2785 -0.1701 0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0
  10925. -0.9129 1.0290 -0.4956 C 0 0 0 0 0 0 0 0 0 0 0 0
  10926. 0.3682 1.4093 -0.6936 N 0 0 0 0 0 0 0 0 0 0 0 0
  10927. 1.3253 0.5497 -0.2815 C 0 0 0 0 0 0 0 0 0 0 0 0
  10928. 1.0589 -0.6707 0.3187 C 0 0 0 0 0 0 0 0 0 0 0 0
  10929. -0.5180 -1.9829 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
  10930. -2.3238 -0.4240 0.2291 H 0 0 0 0 0 0 0 0 0 0 0 0
  10931. -1.6631 1.7371 -0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0
  10932. 2.3464 0.8784 -0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0
  10933. 1.8678 -1.3217 0.6301 H 0 0 0 0 0 0 0 0 0 0 0 0
  10934. 1 2 2 0
  10935. 2 3 1 0
  10936. 3 4 2 0
  10937. 4 5 1 0
  10938. 5 6 2 0
  10939. 6 1 1 0
  10940. 1 7 1 0
  10941. 2 8 1 0
  10942. 3 9 1 0
  10943. 5 10 1 0
  10944. 6 11 1 0
  10945. M END
  10946. $$$$
  10947. RDKit 3D
  10948. 11 11 0 0 0 0 0 0 0 0999 V2000
  10949. -0.2702 -1.0373 0.5025 C 0 0 0 0 0 0 0 0 0 0 0 0
  10950. -1.2785 -0.1707 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
  10951. -0.9129 1.0321 -0.4891 C 0 0 0 0 0 0 0 0 0 0 0 0
  10952. 0.3682 1.4136 -0.6848 N 0 0 0 0 0 0 0 0 0 0 0 0
  10953. 1.3253 0.5515 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0
  10954. 1.0589 -0.6727 0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0
  10955. -0.5180 -1.9890 0.9635 H 0 0 0 0 0 0 0 0 0 0 0 0
  10956. -2.3238 -0.4254 0.2264 H 0 0 0 0 0 0 0 0 0 0 0 0
  10957. -1.6631 1.7423 -0.8245 H 0 0 0 0 0 0 0 0 0 0 0 0
  10958. 2.3464 0.8812 -0.4463 H 0 0 0 0 0 0 0 0 0 0 0 0
  10959. 1.8678 -1.3256 0.6218 H 0 0 0 0 0 0 0 0 0 0 0 0
  10960. 1 2 2 0
  10961. 2 3 1 0
  10962. 3 4 2 0
  10963. 4 5 1 0
  10964. 5 6 2 0
  10965. 6 1 1 0
  10966. 1 7 1 0
  10967. 2 8 1 0
  10968. 3 9 1 0
  10969. 5 10 1 0
  10970. 6 11 1 0
  10971. M END
  10972. $$$$
  10973. RDKit 3D
  10974. 11 11 0 0 0 0 0 0 0 0999 V2000
  10975. -0.2702 -1.0405 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0
  10976. -1.2785 -0.1713 0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0
  10977. -0.9129 1.0352 -0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0
  10978. 0.3682 1.4179 -0.6759 N 0 0 0 0 0 0 0 0 0 0 0 0
  10979. 1.3253 0.5532 -0.2745 C 0 0 0 0 0 0 0 0 0 0 0 0
  10980. 1.0589 -0.6746 0.3103 C 0 0 0 0 0 0 0 0 0 0 0 0
  10981. -0.5180 -1.9950 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
  10982. -2.3238 -0.4268 0.2237 H 0 0 0 0 0 0 0 0 0 0 0 0
  10983. -1.6631 1.7474 -0.8135 H 0 0 0 0 0 0 0 0 0 0 0 0
  10984. 2.3464 0.8840 -0.4408 H 0 0 0 0 0 0 0 0 0 0 0 0
  10985. 1.8678 -1.3295 0.6134 H 0 0 0 0 0 0 0 0 0 0 0 0
  10986. 1 2 2 0
  10987. 2 3 1 0
  10988. 3 4 2 0
  10989. 4 5 1 0
  10990. 5 6 2 0
  10991. 6 1 1 0
  10992. 1 7 1 0
  10993. 2 8 1 0
  10994. 3 9 1 0
  10995. 5 10 1 0
  10996. 6 11 1 0
  10997. M END
  10998. $$$$
  10999. RDKit 3D
  11000. 11 11 0 0 0 0 0 0 0 0999 V2000
  11001. -0.2702 -1.0436 0.4894 C 0 0 0 0 0 0 0 0 0 0 0 0
  11002. -1.2785 -0.1718 0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0
  11003. -0.9129 1.0382 -0.4761 C 0 0 0 0 0 0 0 0 0 0 0 0
  11004. 0.3682 1.4221 -0.6669 N 0 0 0 0 0 0 0 0 0 0 0 0
  11005. 1.3253 0.5549 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0
  11006. 1.0589 -0.6766 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0
  11007. -0.5180 -2.0010 0.9384 H 0 0 0 0 0 0 0 0 0 0 0 0
  11008. -2.3238 -0.4282 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  11009. -1.6631 1.7525 -0.8026 H 0 0 0 0 0 0 0 0 0 0 0 0
  11010. 2.3464 0.8867 -0.4352 H 0 0 0 0 0 0 0 0 0 0 0 0
  11011. 1.8678 -1.3333 0.6051 H 0 0 0 0 0 0 0 0 0 0 0 0
  11012. 1 2 2 0
  11013. 2 3 1 0
  11014. 3 4 2 0
  11015. 4 5 1 0
  11016. 5 6 2 0
  11017. 6 1 1 0
  11018. 1 7 1 0
  11019. 2 8 1 0
  11020. 3 9 1 0
  11021. 5 10 1 0
  11022. 6 11 1 0
  11023. M END
  11024. $$$$
  11025. RDKit 3D
  11026. 11 11 0 0 0 0 0 0 0 0999 V2000
  11027. -0.2702 -1.0466 0.4829 C 0 0 0 0 0 0 0 0 0 0 0 0
  11028. -1.2785 -0.1724 0.0908 C 0 0 0 0 0 0 0 0 0 0 0 0
  11029. -0.9129 1.0412 -0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0
  11030. 0.3682 1.4263 -0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0
  11031. 1.3253 0.5566 -0.2675 C 0 0 0 0 0 0 0 0 0 0 0 0
  11032. 1.0589 -0.6785 0.3018 C 0 0 0 0 0 0 0 0 0 0 0 0
  11033. -0.5180 -2.0068 0.9258 H 0 0 0 0 0 0 0 0 0 0 0 0
  11034. -2.3238 -0.4296 0.2184 H 0 0 0 0 0 0 0 0 0 0 0 0
  11035. -1.6631 1.7575 -0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0
  11036. 2.3464 0.8895 -0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0
  11037. 1.8678 -1.3371 0.5967 H 0 0 0 0 0 0 0 0 0 0 0 0
  11038. 1 2 2 0
  11039. 2 3 1 0
  11040. 3 4 2 0
  11041. 4 5 1 0
  11042. 5 6 2 0
  11043. 6 1 1 0
  11044. 1 7 1 0
  11045. 2 8 1 0
  11046. 3 9 1 0
  11047. 5 10 1 0
  11048. 6 11 1 0
  11049. M END
  11050. $$$$
  11051. RDKit 3D
  11052. 11 11 0 0 0 0 0 0 0 0999 V2000
  11053. -0.2702 -1.0496 0.4763 C 0 0 0 0 0 0 0 0 0 0 0 0
  11054. -1.2785 -0.1730 0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0
  11055. -0.9129 1.0441 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0
  11056. 0.3682 1.4304 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0
  11057. 1.3253 0.5583 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
  11058. 1.0589 -0.6803 0.2975 C 0 0 0 0 0 0 0 0 0 0 0 0
  11059. -0.5180 -2.0126 0.9132 H 0 0 0 0 0 0 0 0 0 0 0 0
  11060. -2.3238 -0.4310 0.2156 H 0 0 0 0 0 0 0 0 0 0 0 0
  11061. -1.6631 1.7625 -0.7805 H 0 0 0 0 0 0 0 0 0 0 0 0
  11062. 2.3464 0.8921 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  11063. 1.8678 -1.3408 0.5883 H 0 0 0 0 0 0 0 0 0 0 0 0
  11064. 1 2 2 0
  11065. 2 3 1 0
  11066. 3 4 2 0
  11067. 4 5 1 0
  11068. 5 6 2 0
  11069. 6 1 1 0
  11070. 1 7 1 0
  11071. 2 8 1 0
  11072. 3 9 1 0
  11073. 5 10 1 0
  11074. 6 11 1 0
  11075. M END
  11076. $$$$
  11077. RDKit 3D
  11078. 11 11 0 0 0 0 0 0 0 0999 V2000
  11079. -0.2702 -1.0526 0.4697 C 0 0 0 0 0 0 0 0 0 0 0 0
  11080. -1.2785 -0.1735 0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0
  11081. -0.9129 1.0470 -0.4564 C 0 0 0 0 0 0 0 0 0 0 0 0
  11082. 0.3682 1.4344 -0.6400 N 0 0 0 0 0 0 0 0 0 0 0 0
  11083. 1.3253 0.5599 -0.2605 C 0 0 0 0 0 0 0 0 0 0 0 0
  11084. 1.0589 -0.6822 0.2932 C 0 0 0 0 0 0 0 0 0 0 0 0
  11085. -0.5180 -2.0183 0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0
  11086. -2.3238 -0.4323 0.2129 H 0 0 0 0 0 0 0 0 0 0 0 0
  11087. -1.6631 1.7673 -0.7694 H 0 0 0 0 0 0 0 0 0 0 0 0
  11088. 2.3464 0.8948 -0.4184 H 0 0 0 0 0 0 0 0 0 0 0 0
  11089. 1.8678 -1.3445 0.5798 H 0 0 0 0 0 0 0 0 0 0 0 0
  11090. 1 2 2 0
  11091. 2 3 1 0
  11092. 3 4 2 0
  11093. 4 5 1 0
  11094. 5 6 2 0
  11095. 6 1 1 0
  11096. 1 7 1 0
  11097. 2 8 1 0
  11098. 3 9 1 0
  11099. 5 10 1 0
  11100. 6 11 1 0
  11101. M END
  11102. $$$$
  11103. RDKit 3D
  11104. 11 11 0 0 0 0 0 0 0 0999 V2000
  11105. -0.2702 -1.0555 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0
  11106. -1.2785 -0.1741 0.0875 C 0 0 0 0 0 0 0 0 0 0 0 0
  11107. -0.9129 1.0498 -0.4499 C 0 0 0 0 0 0 0 0 0 0 0 0
  11108. 0.3682 1.4384 -0.6310 N 0 0 0 0 0 0 0 0 0 0 0 0
  11109. 1.3253 0.5615 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  11110. 1.0589 -0.6840 0.2889 C 0 0 0 0 0 0 0 0 0 0 0 0
  11111. -0.5180 -2.0239 0.8878 H 0 0 0 0 0 0 0 0 0 0 0 0
  11112. -2.3238 -0.4336 0.2102 H 0 0 0 0 0 0 0 0 0 0 0 0
  11113. -1.6631 1.7721 -0.7583 H 0 0 0 0 0 0 0 0 0 0 0 0
  11114. 2.3464 0.8974 -0.4128 H 0 0 0 0 0 0 0 0 0 0 0 0
  11115. 1.8678 -1.3481 0.5714 H 0 0 0 0 0 0 0 0 0 0 0 0
  11116. 1 2 2 0
  11117. 2 3 1 0
  11118. 3 4 2 0
  11119. 4 5 1 0
  11120. 5 6 2 0
  11121. 6 1 1 0
  11122. 1 7 1 0
  11123. 2 8 1 0
  11124. 3 9 1 0
  11125. 5 10 1 0
  11126. 6 11 1 0
  11127. M END
  11128. $$$$
  11129. RDKit 3D
  11130. 11 11 0 0 0 0 0 0 0 0999 V2000
  11131. -0.2702 -1.0584 0.4564 C 0 0 0 0 0 0 0 0 0 0 0 0
  11132. -1.2785 -0.1746 0.0864 C 0 0 0 0 0 0 0 0 0 0 0 0
  11133. -0.9129 1.0526 -0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0
  11134. 0.3682 1.4423 -0.6219 N 0 0 0 0 0 0 0 0 0 0 0 0
  11135. 1.3253 0.5631 -0.2535 C 0 0 0 0 0 0 0 0 0 0 0 0
  11136. 1.0589 -0.6858 0.2846 C 0 0 0 0 0 0 0 0 0 0 0 0
  11137. -0.5180 -2.0295 0.8751 H 0 0 0 0 0 0 0 0 0 0 0 0
  11138. -2.3238 -0.4349 0.2075 H 0 0 0 0 0 0 0 0 0 0 0 0
  11139. -1.6631 1.7769 -0.7471 H 0 0 0 0 0 0 0 0 0 0 0 0
  11140. 2.3464 0.9000 -0.4071 H 0 0 0 0 0 0 0 0 0 0 0 0
  11141. 1.8678 -1.3516 0.5629 H 0 0 0 0 0 0 0 0 0 0 0 0
  11142. 1 2 2 0
  11143. 2 3 1 0
  11144. 3 4 2 0
  11145. 4 5 1 0
  11146. 5 6 2 0
  11147. 6 1 1 0
  11148. 1 7 1 0
  11149. 2 8 1 0
  11150. 3 9 1 0
  11151. 5 10 1 0
  11152. 6 11 1 0
  11153. M END
  11154. $$$$
  11155. RDKit 3D
  11156. 11 11 0 0 0 0 0 0 0 0999 V2000
  11157. -0.2702 -1.0613 0.4497 C 0 0 0 0 0 0 0 0 0 0 0 0
  11158. -1.2785 -0.1752 0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0
  11159. -0.9129 1.0554 -0.4366 C 0 0 0 0 0 0 0 0 0 0 0 0
  11160. 0.3682 1.4462 -0.6129 N 0 0 0 0 0 0 0 0 0 0 0 0
  11161. 1.3253 0.5647 -0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0
  11162. 1.0589 -0.6876 0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0
  11163. -0.5180 -2.0349 0.8623 H 0 0 0 0 0 0 0 0 0 0 0 0
  11164. -2.3238 -0.4362 0.2048 H 0 0 0 0 0 0 0 0 0 0 0 0
  11165. -1.6631 1.7815 -0.7359 H 0 0 0 0 0 0 0 0 0 0 0 0
  11166. 2.3464 0.9025 -0.4015 H 0 0 0 0 0 0 0 0 0 0 0 0
  11167. 1.8678 -1.3552 0.5544 H 0 0 0 0 0 0 0 0 0 0 0 0
  11168. 1 2 2 0
  11169. 2 3 1 0
  11170. 3 4 2 0
  11171. 4 5 1 0
  11172. 5 6 2 0
  11173. 6 1 1 0
  11174. 1 7 1 0
  11175. 2 8 1 0
  11176. 3 9 1 0
  11177. 5 10 1 0
  11178. 6 11 1 0
  11179. M END
  11180. $$$$
  11181. RDKit 3D
  11182. 11 11 0 0 0 0 0 0 0 0999 V2000
  11183. -0.2702 -1.0641 0.4431 C 0 0 0 0 0 0 0 0 0 0 0 0
  11184. -1.2785 -0.1757 0.0842 C 0 0 0 0 0 0 0 0 0 0 0 0
  11185. -0.9129 1.0581 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0
  11186. 0.3682 1.4501 -0.6038 N 0 0 0 0 0 0 0 0 0 0 0 0
  11187. 1.3253 0.5663 -0.2464 C 0 0 0 0 0 0 0 0 0 0 0 0
  11188. 1.0589 -0.6894 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0
  11189. -0.5180 -2.0403 0.8495 H 0 0 0 0 0 0 0 0 0 0 0 0
  11190. -2.3238 -0.4375 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0
  11191. -1.6631 1.7861 -0.7247 H 0 0 0 0 0 0 0 0 0 0 0 0
  11192. 2.3464 0.9050 -0.3958 H 0 0 0 0 0 0 0 0 0 0 0 0
  11193. 1.8678 -1.3586 0.5459 H 0 0 0 0 0 0 0 0 0 0 0 0
  11194. 1 2 2 0
  11195. 2 3 1 0
  11196. 3 4 2 0
  11197. 4 5 1 0
  11198. 5 6 2 0
  11199. 6 1 1 0
  11200. 1 7 1 0
  11201. 2 8 1 0
  11202. 3 9 1 0
  11203. 5 10 1 0
  11204. 6 11 1 0
  11205. M END
  11206. $$$$
  11207. RDKit 3D
  11208. 11 11 0 0 0 0 0 0 0 0999 V2000
  11209. -0.2702 -1.0668 0.4364 C 0 0 0 0 0 0 0 0 0 0 0 0
  11210. -1.2785 -0.1762 0.0831 C 0 0 0 0 0 0 0 0 0 0 0 0
  11211. -0.9129 1.0608 -0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0
  11212. 0.3682 1.4538 -0.5946 N 0 0 0 0 0 0 0 0 0 0 0 0
  11213. 1.3253 0.5678 -0.2428 C 0 0 0 0 0 0 0 0 0 0 0 0
  11214. 1.0589 -0.6911 0.2716 C 0 0 0 0 0 0 0 0 0 0 0 0
  11215. -0.5180 -2.0456 0.8367 H 0 0 0 0 0 0 0 0 0 0 0 0
  11216. -2.3238 -0.4388 0.1993 H 0 0 0 0 0 0 0 0 0 0 0 0
  11217. -1.6631 1.7906 -0.7135 H 0 0 0 0 0 0 0 0 0 0 0 0
  11218. 2.3464 0.9075 -0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0
  11219. 1.8678 -1.3620 0.5373 H 0 0 0 0 0 0 0 0 0 0 0 0
  11220. 1 2 2 0
  11221. 2 3 1 0
  11222. 3 4 2 0
  11223. 4 5 1 0
  11224. 5 6 2 0
  11225. 6 1 1 0
  11226. 1 7 1 0
  11227. 2 8 1 0
  11228. 3 9 1 0
  11229. 5 10 1 0
  11230. 6 11 1 0
  11231. M END
  11232. $$$$
  11233. RDKit 3D
  11234. 11 11 0 0 0 0 0 0 0 0999 V2000
  11235. -0.2702 -1.0696 0.4297 C 0 0 0 0 0 0 0 0 0 0 0 0
  11236. -1.2785 -0.1768 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  11237. -0.9129 1.0634 -0.4167 C 0 0 0 0 0 0 0 0 0 0 0 0
  11238. 0.3682 1.4575 -0.5855 N 0 0 0 0 0 0 0 0 0 0 0 0
  11239. 1.3253 0.5693 -0.2392 C 0 0 0 0 0 0 0 0 0 0 0 0
  11240. 1.0589 -0.6928 0.2673 C 0 0 0 0 0 0 0 0 0 0 0 0
  11241. -0.5180 -2.0508 0.8238 H 0 0 0 0 0 0 0 0 0 0 0 0
  11242. -2.3238 -0.4400 0.1965 H 0 0 0 0 0 0 0 0 0 0 0 0
  11243. -1.6631 1.7951 -0.7022 H 0 0 0 0 0 0 0 0 0 0 0 0
  11244. 2.3464 0.9099 -0.3844 H 0 0 0 0 0 0 0 0 0 0 0 0
  11245. 1.8678 -1.3654 0.5287 H 0 0 0 0 0 0 0 0 0 0 0 0
  11246. 1 2 2 0
  11247. 2 3 1 0
  11248. 3 4 2 0
  11249. 4 5 1 0
  11250. 5 6 2 0
  11251. 6 1 1 0
  11252. 1 7 1 0
  11253. 2 8 1 0
  11254. 3 9 1 0
  11255. 5 10 1 0
  11256. 6 11 1 0
  11257. M END
  11258. $$$$
  11259. RDKit 3D
  11260. 11 11 0 0 0 0 0 0 0 0999 V2000
  11261. -0.2702 -1.0722 0.4229 C 0 0 0 0 0 0 0 0 0 0 0 0
  11262. -1.2785 -0.1773 0.0809 C 0 0 0 0 0 0 0 0 0 0 0 0
  11263. -0.9129 1.0660 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0
  11264. 0.3682 1.4612 -0.5763 N 0 0 0 0 0 0 0 0 0 0 0 0
  11265. 1.3253 0.5708 -0.2357 C 0 0 0 0 0 0 0 0 0 0 0 0
  11266. 1.0589 -0.6944 0.2629 C 0 0 0 0 0 0 0 0 0 0 0 0
  11267. -0.5180 -2.0560 0.8109 H 0 0 0 0 0 0 0 0 0 0 0 0
  11268. -2.3238 -0.4412 0.1937 H 0 0 0 0 0 0 0 0 0 0 0 0
  11269. -1.6631 1.7995 -0.6909 H 0 0 0 0 0 0 0 0 0 0 0 0
  11270. 2.3464 0.9123 -0.3787 H 0 0 0 0 0 0 0 0 0 0 0 0
  11271. 1.8678 -1.3687 0.5202 H 0 0 0 0 0 0 0 0 0 0 0 0
  11272. 1 2 2 0
  11273. 2 3 1 0
  11274. 3 4 2 0
  11275. 4 5 1 0
  11276. 5 6 2 0
  11277. 6 1 1 0
  11278. 1 7 1 0
  11279. 2 8 1 0
  11280. 3 9 1 0
  11281. 5 10 1 0
  11282. 6 11 1 0
  11283. M END
  11284. $$$$
  11285. RDKit 3D
  11286. 11 11 0 0 0 0 0 0 0 0999 V2000
  11287. -0.2702 -1.0749 0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0
  11288. -1.2785 -0.1778 0.0798 C 0 0 0 0 0 0 0 0 0 0 0 0
  11289. -0.9129 1.0686 -0.4033 C 0 0 0 0 0 0 0 0 0 0 0 0
  11290. 0.3682 1.4648 -0.5671 N 0 0 0 0 0 0 0 0 0 0 0 0
  11291. 1.3253 0.5723 -0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
  11292. 1.0589 -0.6961 0.2586 C 0 0 0 0 0 0 0 0 0 0 0 0
  11293. -0.5180 -2.0610 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0
  11294. -2.3238 -0.4425 0.1909 H 0 0 0 0 0 0 0 0 0 0 0 0
  11295. -1.6631 1.8038 -0.6796 H 0 0 0 0 0 0 0 0 0 0 0 0
  11296. 2.3464 0.9147 -0.3729 H 0 0 0 0 0 0 0 0 0 0 0 0
  11297. 1.8678 -1.3719 0.5115 H 0 0 0 0 0 0 0 0 0 0 0 0
  11298. 1 2 2 0
  11299. 2 3 1 0
  11300. 3 4 2 0
  11301. 4 5 1 0
  11302. 5 6 2 0
  11303. 6 1 1 0
  11304. 1 7 1 0
  11305. 2 8 1 0
  11306. 3 9 1 0
  11307. 5 10 1 0
  11308. 6 11 1 0
  11309. M END
  11310. $$$$
  11311. RDKit 3D
  11312. 11 11 0 0 0 0 0 0 0 0999 V2000
  11313. -0.2702 -1.0775 0.4094 C 0 0 0 0 0 0 0 0 0 0 0 0
  11314. -1.2785 -0.1783 0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0
  11315. -0.9129 1.0711 -0.3965 C 0 0 0 0 0 0 0 0 0 0 0 0
  11316. 0.3682 1.4683 -0.5579 N 0 0 0 0 0 0 0 0 0 0 0 0
  11317. 1.3253 0.5737 -0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0
  11318. 1.0589 -0.6977 0.2542 C 0 0 0 0 0 0 0 0 0 0 0 0
  11319. -0.5180 -2.0660 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0
  11320. -2.3238 -0.4436 0.1882 H 0 0 0 0 0 0 0 0 0 0 0 0
  11321. -1.6631 1.8080 -0.6683 H 0 0 0 0 0 0 0 0 0 0 0 0
  11322. 2.3464 0.9170 -0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0
  11323. 1.8678 -1.3751 0.5029 H 0 0 0 0 0 0 0 0 0 0 0 0
  11324. 1 2 2 0
  11325. 2 3 1 0
  11326. 3 4 2 0
  11327. 4 5 1 0
  11328. 5 6 2 0
  11329. 6 1 1 0
  11330. 1 7 1 0
  11331. 2 8 1 0
  11332. 3 9 1 0
  11333. 5 10 1 0
  11334. 6 11 1 0
  11335. M END
  11336. $$$$
  11337. RDKit 3D
  11338. 11 11 0 0 0 0 0 0 0 0999 V2000
  11339. -0.2702 -1.0800 0.4026 C 0 0 0 0 0 0 0 0 0 0 0 0
  11340. -1.2785 -0.1788 0.0775 C 0 0 0 0 0 0 0 0 0 0 0 0
  11341. -0.9129 1.0736 -0.3898 C 0 0 0 0 0 0 0 0 0 0 0 0
  11342. 0.3682 1.4718 -0.5487 N 0 0 0 0 0 0 0 0 0 0 0 0
  11343. 1.3253 0.5752 -0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0
  11344. 1.0589 -0.6993 0.2498 C 0 0 0 0 0 0 0 0 0 0 0 0
  11345. -0.5180 -2.0709 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0
  11346. -2.3238 -0.4448 0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0
  11347. -1.6631 1.8122 -0.6569 H 0 0 0 0 0 0 0 0 0 0 0 0
  11348. 2.3464 0.9193 -0.3614 H 0 0 0 0 0 0 0 0 0 0 0 0
  11349. 1.8678 -1.3782 0.4943 H 0 0 0 0 0 0 0 0 0 0 0 0
  11350. 1 2 2 0
  11351. 2 3 1 0
  11352. 3 4 2 0
  11353. 4 5 1 0
  11354. 5 6 2 0
  11355. 6 1 1 0
  11356. 1 7 1 0
  11357. 2 8 1 0
  11358. 3 9 1 0
  11359. 5 10 1 0
  11360. 6 11 1 0
  11361. M END
  11362. $$$$
  11363. RDKit 3D
  11364. 11 11 0 0 0 0 0 0 0 0999 V2000
  11365. -0.2702 -1.0825 0.3958 C 0 0 0 0 0 0 0 0 0 0 0 0
  11366. -1.2785 -0.1792 0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0
  11367. -0.9129 1.0760 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0
  11368. 0.3682 1.4752 -0.5394 N 0 0 0 0 0 0 0 0 0 0 0 0
  11369. 1.3253 0.5766 -0.2212 C 0 0 0 0 0 0 0 0 0 0 0 0
  11370. 1.0589 -0.7008 0.2454 C 0 0 0 0 0 0 0 0 0 0 0 0
  11371. -0.5180 -2.0757 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0
  11372. -2.3238 -0.4460 0.1826 H 0 0 0 0 0 0 0 0 0 0 0 0
  11373. -1.6631 1.8162 -0.6455 H 0 0 0 0 0 0 0 0 0 0 0 0
  11374. 2.3464 0.9215 -0.3556 H 0 0 0 0 0 0 0 0 0 0 0 0
  11375. 1.8678 -1.3813 0.4856 H 0 0 0 0 0 0 0 0 0 0 0 0
  11376. 1 2 2 0
  11377. 2 3 1 0
  11378. 3 4 2 0
  11379. 4 5 1 0
  11380. 5 6 2 0
  11381. 6 1 1 0
  11382. 1 7 1 0
  11383. 2 8 1 0
  11384. 3 9 1 0
  11385. 5 10 1 0
  11386. 6 11 1 0
  11387. M END
  11388. $$$$
  11389. RDKit 3D
  11390. 11 11 0 0 0 0 0 0 0 0999 V2000
  11391. -0.2702 -1.0850 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0
  11392. -1.2785 -0.1797 0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0
  11393. -0.9129 1.0784 -0.3763 C 0 0 0 0 0 0 0 0 0 0 0 0
  11394. 0.3682 1.4786 -0.5301 N 0 0 0 0 0 0 0 0 0 0 0 0
  11395. 1.3253 0.5779 -0.2176 C 0 0 0 0 0 0 0 0 0 0 0 0
  11396. 1.0589 -0.7023 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0
  11397. -0.5180 -2.0804 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0
  11398. -2.3238 -0.4471 0.1798 H 0 0 0 0 0 0 0 0 0 0 0 0
  11399. -1.6631 1.8203 -0.6341 H 0 0 0 0 0 0 0 0 0 0 0 0
  11400. 2.3464 0.9238 -0.3498 H 0 0 0 0 0 0 0 0 0 0 0 0
  11401. 1.8678 -1.3843 0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
  11402. 1 2 2 0
  11403. 2 3 1 0
  11404. 3 4 2 0
  11405. 4 5 1 0
  11406. 5 6 2 0
  11407. 6 1 1 0
  11408. 1 7 1 0
  11409. 2 8 1 0
  11410. 3 9 1 0
  11411. 5 10 1 0
  11412. 6 11 1 0
  11413. M END
  11414. $$$$
  11415. RDKit 3D
  11416. 11 11 0 0 0 0 0 0 0 0999 V2000
  11417. -0.2702 -1.0874 0.3822 C 0 0 0 0 0 0 0 0 0 0 0 0
  11418. -1.2785 -0.1802 0.0742 C 0 0 0 0 0 0 0 0 0 0 0 0
  11419. -0.9129 1.0807 -0.3695 C 0 0 0 0 0 0 0 0 0 0 0 0
  11420. 0.3682 1.4819 -0.5208 N 0 0 0 0 0 0 0 0 0 0 0 0
  11421. 1.3253 0.5793 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0
  11422. 1.0589 -0.7039 0.2366 C 0 0 0 0 0 0 0 0 0 0 0 0
  11423. -0.5180 -2.0851 0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0
  11424. -2.3238 -0.4482 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0
  11425. -1.6631 1.8242 -0.6226 H 0 0 0 0 0 0 0 0 0 0 0 0
  11426. 2.3464 0.9259 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0
  11427. 1.8678 -1.3873 0.4682 H 0 0 0 0 0 0 0 0 0 0 0 0
  11428. 1 2 2 0
  11429. 2 3 1 0
  11430. 3 4 2 0
  11431. 4 5 1 0
  11432. 5 6 2 0
  11433. 6 1 1 0
  11434. 1 7 1 0
  11435. 2 8 1 0
  11436. 3 9 1 0
  11437. 5 10 1 0
  11438. 6 11 1 0
  11439. M END
  11440. $$$$
  11441. RDKit 3D
  11442. 11 11 0 0 0 0 0 0 0 0999 V2000
  11443. -0.2702 -1.0898 0.3754 C 0 0 0 0 0 0 0 0 0 0 0 0
  11444. -1.2785 -0.1807 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
  11445. -0.9129 1.0830 -0.3627 C 0 0 0 0 0 0 0 0 0 0 0 0
  11446. 0.3682 1.4851 -0.5115 N 0 0 0 0 0 0 0 0 0 0 0 0
  11447. 1.3253 0.5806 -0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0
  11448. 1.0589 -0.7053 0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
  11449. -0.5180 -2.0896 0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0
  11450. -2.3238 -0.4493 0.1741 H 0 0 0 0 0 0 0 0 0 0 0 0
  11451. -1.6631 1.8281 -0.6111 H 0 0 0 0 0 0 0 0 0 0 0 0
  11452. 2.3464 0.9281 -0.3382 H 0 0 0 0 0 0 0 0 0 0 0 0
  11453. 1.8678 -1.3902 0.4595 H 0 0 0 0 0 0 0 0 0 0 0 0
  11454. 1 2 2 0
  11455. 2 3 1 0
  11456. 3 4 2 0
  11457. 4 5 1 0
  11458. 5 6 2 0
  11459. 6 1 1 0
  11460. 1 7 1 0
  11461. 2 8 1 0
  11462. 3 9 1 0
  11463. 5 10 1 0
  11464. 6 11 1 0
  11465. M END
  11466. $$$$
  11467. RDKit 3D
  11468. 11 11 0 0 0 0 0 0 0 0999 V2000
  11469. -0.2702 -1.0921 0.3685 C 0 0 0 0 0 0 0 0 0 0 0 0
  11470. -1.2785 -0.1811 0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0
  11471. -0.9129 1.0853 -0.3559 C 0 0 0 0 0 0 0 0 0 0 0 0
  11472. 0.3682 1.4883 -0.5022 N 0 0 0 0 0 0 0 0 0 0 0 0
  11473. 1.3253 0.5819 -0.2067 C 0 0 0 0 0 0 0 0 0 0 0 0
  11474. 1.0589 -0.7068 0.2277 C 0 0 0 0 0 0 0 0 0 0 0 0
  11475. -0.5180 -2.0941 0.7066 H 0 0 0 0 0 0 0 0 0 0 0 0
  11476. -2.3238 -0.4504 0.1713 H 0 0 0 0 0 0 0 0 0 0 0 0
  11477. -1.6631 1.8319 -0.5996 H 0 0 0 0 0 0 0 0 0 0 0 0
  11478. 2.3464 0.9302 -0.3324 H 0 0 0 0 0 0 0 0 0 0 0 0
  11479. 1.8678 -1.3931 0.4507 H 0 0 0 0 0 0 0 0 0 0 0 0
  11480. 1 2 2 0
  11481. 2 3 1 0
  11482. 3 4 2 0
  11483. 4 5 1 0
  11484. 5 6 2 0
  11485. 6 1 1 0
  11486. 1 7 1 0
  11487. 2 8 1 0
  11488. 3 9 1 0
  11489. 5 10 1 0
  11490. 6 11 1 0
  11491. M END
  11492. $$$$
  11493. RDKit 3D
  11494. 11 11 0 0 0 0 0 0 0 0999 V2000
  11495. -0.2702 -1.0944 0.3616 C 0 0 0 0 0 0 0 0 0 0 0 0
  11496. -1.2785 -0.1816 0.0707 C 0 0 0 0 0 0 0 0 0 0 0 0
  11497. -0.9129 1.0875 -0.3491 C 0 0 0 0 0 0 0 0 0 0 0 0
  11498. 0.3682 1.4914 -0.4928 N 0 0 0 0 0 0 0 0 0 0 0 0
  11499. 1.3253 0.5832 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0
  11500. 1.0589 -0.7082 0.2233 C 0 0 0 0 0 0 0 0 0 0 0 0
  11501. -0.5180 -2.0985 0.6934 H 0 0 0 0 0 0 0 0 0 0 0 0
  11502. -2.3238 -0.4515 0.1685 H 0 0 0 0 0 0 0 0 0 0 0 0
  11503. -1.6631 1.8356 -0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0
  11504. 2.3464 0.9323 -0.3265 H 0 0 0 0 0 0 0 0 0 0 0 0
  11505. 1.8678 -1.3959 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
  11506. 1 2 2 0
  11507. 2 3 1 0
  11508. 3 4 2 0
  11509. 4 5 1 0
  11510. 5 6 2 0
  11511. 6 1 1 0
  11512. 1 7 1 0
  11513. 2 8 1 0
  11514. 3 9 1 0
  11515. 5 10 1 0
  11516. 6 11 1 0
  11517. M END
  11518. $$$$
  11519. RDKit 3D
  11520. 11 11 0 0 0 0 0 0 0 0999 V2000
  11521. -0.2702 -1.0967 0.3548 C 0 0 0 0 0 0 0 0 0 0 0 0
  11522. -1.2785 -0.1820 0.0696 C 0 0 0 0 0 0 0 0 0 0 0 0
  11523. -0.9129 1.0897 -0.3422 C 0 0 0 0 0 0 0 0 0 0 0 0
  11524. 0.3682 1.4945 -0.4834 N 0 0 0 0 0 0 0 0 0 0 0 0
  11525. 1.3253 0.5845 -0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0
  11526. 1.0589 -0.7096 0.2188 C 0 0 0 0 0 0 0 0 0 0 0 0
  11527. -0.5180 -2.1028 0.6802 H 0 0 0 0 0 0 0 0 0 0 0 0
  11528. -2.3238 -0.4525 0.1656 H 0 0 0 0 0 0 0 0 0 0 0 0
  11529. -1.6631 1.8393 -0.5766 H 0 0 0 0 0 0 0 0 0 0 0 0
  11530. 2.3464 0.9343 -0.3206 H 0 0 0 0 0 0 0 0 0 0 0 0
  11531. 1.8678 -1.3986 0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
  11532. 1 2 2 0
  11533. 2 3 1 0
  11534. 3 4 2 0
  11535. 4 5 1 0
  11536. 5 6 2 0
  11537. 6 1 1 0
  11538. 1 7 1 0
  11539. 2 8 1 0
  11540. 3 9 1 0
  11541. 5 10 1 0
  11542. 6 11 1 0
  11543. M END
  11544. $$$$
  11545. RDKit 3D
  11546. 11 11 0 0 0 0 0 0 0 0999 V2000
  11547. -0.2702 -1.0989 0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0
  11548. -1.2785 -0.1824 0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0
  11549. -0.9129 1.0918 -0.3354 C 0 0 0 0 0 0 0 0 0 0 0 0
  11550. 0.3682 1.4975 -0.4740 N 0 0 0 0 0 0 0 0 0 0 0 0
  11551. 1.3253 0.5857 -0.1957 C 0 0 0 0 0 0 0 0 0 0 0 0
  11552. 1.0589 -0.7109 0.2143 C 0 0 0 0 0 0 0 0 0 0 0 0
  11553. -0.5180 -2.1071 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0
  11554. -2.3238 -0.4536 0.1628 H 0 0 0 0 0 0 0 0 0 0 0 0
  11555. -1.6631 1.8429 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0
  11556. 2.3464 0.9363 -0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0
  11557. 1.8678 -1.4013 0.4244 H 0 0 0 0 0 0 0 0 0 0 0 0
  11558. 1 2 2 0
  11559. 2 3 1 0
  11560. 3 4 2 0
  11561. 4 5 1 0
  11562. 5 6 2 0
  11563. 6 1 1 0
  11564. 1 7 1 0
  11565. 2 8 1 0
  11566. 3 9 1 0
  11567. 5 10 1 0
  11568. 6 11 1 0
  11569. M END
  11570. $$$$
  11571. RDKit 3D
  11572. 11 11 0 0 0 0 0 0 0 0999 V2000
  11573. -0.2702 -1.1011 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0
  11574. -1.2785 -0.1829 0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0
  11575. -0.9129 1.0939 -0.3285 C 0 0 0 0 0 0 0 0 0 0 0 0
  11576. 0.3682 1.5004 -0.4646 N 0 0 0 0 0 0 0 0 0 0 0 0
  11577. 1.3253 0.5870 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0
  11578. 1.0589 -0.7123 0.2099 C 0 0 0 0 0 0 0 0 0 0 0 0
  11579. -0.5180 -2.1112 0.6538 H 0 0 0 0 0 0 0 0 0 0 0 0
  11580. -2.3238 -0.4546 0.1599 H 0 0 0 0 0 0 0 0 0 0 0 0
  11581. -1.6631 1.8464 -0.5534 H 0 0 0 0 0 0 0 0 0 0 0 0
  11582. 2.3464 0.9383 -0.3089 H 0 0 0 0 0 0 0 0 0 0 0 0
  11583. 1.8678 -1.4039 0.4156 H 0 0 0 0 0 0 0 0 0 0 0 0
  11584. 1 2 2 0
  11585. 2 3 1 0
  11586. 3 4 2 0
  11587. 4 5 1 0
  11588. 5 6 2 0
  11589. 6 1 1 0
  11590. 1 7 1 0
  11591. 2 8 1 0
  11592. 3 9 1 0
  11593. 5 10 1 0
  11594. 6 11 1 0
  11595. M END
  11596. $$$$
  11597. RDKit 3D
  11598. 11 11 0 0 0 0 0 0 0 0999 V2000
  11599. -0.2702 -1.1032 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0
  11600. -1.2785 -0.1833 0.0662 C 0 0 0 0 0 0 0 0 0 0 0 0
  11601. -0.9129 1.0959 -0.3216 C 0 0 0 0 0 0 0 0 0 0 0 0
  11602. 0.3682 1.5033 -0.4552 N 0 0 0 0 0 0 0 0 0 0 0 0
  11603. 1.3253 0.5882 -0.1883 C 0 0 0 0 0 0 0 0 0 0 0 0
  11604. 1.0589 -0.7136 0.2054 C 0 0 0 0 0 0 0 0 0 0 0 0
  11605. -0.5180 -2.1153 0.6405 H 0 0 0 0 0 0 0 0 0 0 0 0
  11606. -2.3238 -0.4556 0.1571 H 0 0 0 0 0 0 0 0 0 0 0 0
  11607. -1.6631 1.8498 -0.5418 H 0 0 0 0 0 0 0 0 0 0 0 0
  11608. 2.3464 0.9402 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  11609. 1.8678 -1.4065 0.4068 H 0 0 0 0 0 0 0 0 0 0 0 0
  11610. 1 2 2 0
  11611. 2 3 1 0
  11612. 3 4 2 0
  11613. 4 5 1 0
  11614. 5 6 2 0
  11615. 6 1 1 0
  11616. 1 7 1 0
  11617. 2 8 1 0
  11618. 3 9 1 0
  11619. 5 10 1 0
  11620. 6 11 1 0
  11621. M END
  11622. $$$$
  11623. RDKit 3D
  11624. 11 11 0 0 0 0 0 0 0 0999 V2000
  11625. -0.2702 -1.1053 0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0
  11626. -1.2785 -0.1837 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0
  11627. -0.9129 1.0979 -0.3147 C 0 0 0 0 0 0 0 0 0 0 0 0
  11628. 0.3682 1.5062 -0.4457 N 0 0 0 0 0 0 0 0 0 0 0 0
  11629. 1.3253 0.5893 -0.1846 C 0 0 0 0 0 0 0 0 0 0 0 0
  11630. 1.0589 -0.7148 0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0
  11631. -0.5180 -2.1192 0.6272 H 0 0 0 0 0 0 0 0 0 0 0 0
  11632. -2.3238 -0.4566 0.1542 H 0 0 0 0 0 0 0 0 0 0 0 0
  11633. -1.6631 1.8532 -0.5302 H 0 0 0 0 0 0 0 0 0 0 0 0
  11634. 2.3464 0.9421 -0.2971 H 0 0 0 0 0 0 0 0 0 0 0 0
  11635. 1.8678 -1.4091 0.3979 H 0 0 0 0 0 0 0 0 0 0 0 0
  11636. 1 2 2 0
  11637. 2 3 1 0
  11638. 3 4 2 0
  11639. 4 5 1 0
  11640. 5 6 2 0
  11641. 6 1 1 0
  11642. 1 7 1 0
  11643. 2 8 1 0
  11644. 3 9 1 0
  11645. 5 10 1 0
  11646. 6 11 1 0
  11647. M END
  11648. $$$$
  11649. RDKit 3D
  11650. 11 11 0 0 0 0 0 0 0 0999 V2000
  11651. -0.2702 -1.1073 0.3201 C 0 0 0 0 0 0 0 0 0 0 0 0
  11652. -1.2785 -0.1841 0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0
  11653. -0.9129 1.0999 -0.3078 C 0 0 0 0 0 0 0 0 0 0 0 0
  11654. 0.3682 1.5089 -0.4363 N 0 0 0 0 0 0 0 0 0 0 0 0
  11655. 1.3253 0.5905 -0.1809 C 0 0 0 0 0 0 0 0 0 0 0 0
  11656. 1.0589 -0.7161 0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0
  11657. -0.5180 -2.1231 0.6138 H 0 0 0 0 0 0 0 0 0 0 0 0
  11658. -2.3238 -0.4575 0.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
  11659. -1.6631 1.8565 -0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0
  11660. 2.3464 0.9439 -0.2911 H 0 0 0 0 0 0 0 0 0 0 0 0
  11661. 1.8678 -1.4115 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0
  11662. 1 2 2 0
  11663. 2 3 1 0
  11664. 3 4 2 0
  11665. 4 5 1 0
  11666. 5 6 2 0
  11667. 6 1 1 0
  11668. 1 7 1 0
  11669. 2 8 1 0
  11670. 3 9 1 0
  11671. 5 10 1 0
  11672. 6 11 1 0
  11673. M END
  11674. $$$$
  11675. RDKit 3D
  11676. 11 11 0 0 0 0 0 0 0 0999 V2000
  11677. -0.2702 -1.1093 0.3132 C 0 0 0 0 0 0 0 0 0 0 0 0
  11678. -1.2785 -0.1845 0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0
  11679. -0.9129 1.1018 -0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0
  11680. 0.3682 1.5116 -0.4268 N 0 0 0 0 0 0 0 0 0 0 0 0
  11681. 1.3253 0.5916 -0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0
  11682. 1.0589 -0.7173 0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0
  11683. -0.5180 -2.1270 0.6005 H 0 0 0 0 0 0 0 0 0 0 0 0
  11684. -2.3238 -0.4585 0.1485 H 0 0 0 0 0 0 0 0 0 0 0 0
  11685. -1.6631 1.8597 -0.5068 H 0 0 0 0 0 0 0 0 0 0 0 0
  11686. 2.3464 0.9457 -0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0
  11687. 1.8678 -1.4139 0.3802 H 0 0 0 0 0 0 0 0 0 0 0 0
  11688. 1 2 2 0
  11689. 2 3 1 0
  11690. 3 4 2 0
  11691. 4 5 1 0
  11692. 5 6 2 0
  11693. 6 1 1 0
  11694. 1 7 1 0
  11695. 2 8 1 0
  11696. 3 9 1 0
  11697. 5 10 1 0
  11698. 6 11 1 0
  11699. M END
  11700. $$$$
  11701. RDKit 3D
  11702. 11 11 0 0 0 0 0 0 0 0999 V2000
  11703. -0.2702 -1.1112 0.3062 C 0 0 0 0 0 0 0 0 0 0 0 0
  11704. -1.2785 -0.1849 0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0
  11705. -0.9129 1.1037 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0
  11706. 0.3682 1.5143 -0.4173 N 0 0 0 0 0 0 0 0 0 0 0 0
  11707. 1.3253 0.5927 -0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0
  11708. 1.0589 -0.7185 0.1874 C 0 0 0 0 0 0 0 0 0 0 0 0
  11709. -0.5180 -2.1307 0.5871 H 0 0 0 0 0 0 0 0 0 0 0 0
  11710. -2.3238 -0.4594 0.1456 H 0 0 0 0 0 0 0 0 0 0 0 0
  11711. -1.6631 1.8629 -0.4951 H 0 0 0 0 0 0 0 0 0 0 0 0
  11712. 2.3464 0.9475 -0.2793 H 0 0 0 0 0 0 0 0 0 0 0 0
  11713. 1.8678 -1.4163 0.3713 H 0 0 0 0 0 0 0 0 0 0 0 0
  11714. 1 2 2 0
  11715. 2 3 1 0
  11716. 3 4 2 0
  11717. 4 5 1 0
  11718. 5 6 2 0
  11719. 6 1 1 0
  11720. 1 7 1 0
  11721. 2 8 1 0
  11722. 3 9 1 0
  11723. 5 10 1 0
  11724. 6 11 1 0
  11725. M END
  11726. $$$$
  11727. RDKit 3D
  11728. 11 11 0 0 0 0 0 0 0 0999 V2000
  11729. -0.2702 -1.1131 0.2992 C 0 0 0 0 0 0 0 0 0 0 0 0
  11730. -1.2785 -0.1853 0.0604 C 0 0 0 0 0 0 0 0 0 0 0 0
  11731. -0.9129 1.1055 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0
  11732. 0.3682 1.5169 -0.4077 N 0 0 0 0 0 0 0 0 0 0 0 0
  11733. 1.3253 0.5938 -0.1697 C 0 0 0 0 0 0 0 0 0 0 0 0
  11734. 1.0589 -0.7197 0.1829 C 0 0 0 0 0 0 0 0 0 0 0 0
  11735. -0.5180 -2.1343 0.5737 H 0 0 0 0 0 0 0 0 0 0 0 0
  11736. -2.3238 -0.4603 0.1427 H 0 0 0 0 0 0 0 0 0 0 0 0
  11737. -1.6631 1.8659 -0.4834 H 0 0 0 0 0 0 0 0 0 0 0 0
  11738. 2.3464 0.9492 -0.2733 H 0 0 0 0 0 0 0 0 0 0 0 0
  11739. 1.8678 -1.4186 0.3624 H 0 0 0 0 0 0 0 0 0 0 0 0
  11740. 1 2 2 0
  11741. 2 3 1 0
  11742. 3 4 2 0
  11743. 4 5 1 0
  11744. 5 6 2 0
  11745. 6 1 1 0
  11746. 1 7 1 0
  11747. 2 8 1 0
  11748. 3 9 1 0
  11749. 5 10 1 0
  11750. 6 11 1 0
  11751. M END
  11752. $$$$
  11753. RDKit 3D
  11754. 11 11 0 0 0 0 0 0 0 0999 V2000
  11755. -0.2702 -1.1150 0.2922 C 0 0 0 0 0 0 0 0 0 0 0 0
  11756. -1.2785 -0.1856 0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0
  11757. -0.9129 1.1073 -0.2801 C 0 0 0 0 0 0 0 0 0 0 0 0
  11758. 0.3682 1.5194 -0.3982 N 0 0 0 0 0 0 0 0 0 0 0 0
  11759. 1.3253 0.5948 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0
  11760. 1.0589 -0.7208 0.1784 C 0 0 0 0 0 0 0 0 0 0 0 0
  11761. -0.5180 -2.1379 0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0
  11762. -2.3238 -0.4612 0.1398 H 0 0 0 0 0 0 0 0 0 0 0 0
  11763. -1.6631 1.8689 -0.4717 H 0 0 0 0 0 0 0 0 0 0 0 0
  11764. 2.3464 0.9509 -0.2673 H 0 0 0 0 0 0 0 0 0 0 0 0
  11765. 1.8678 -1.4209 0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0
  11766. 1 2 2 0
  11767. 2 3 1 0
  11768. 3 4 2 0
  11769. 4 5 1 0
  11770. 5 6 2 0
  11771. 6 1 1 0
  11772. 1 7 1 0
  11773. 2 8 1 0
  11774. 3 9 1 0
  11775. 5 10 1 0
  11776. 6 11 1 0
  11777. M END
  11778. $$$$
  11779. RDKit 3D
  11780. 11 11 0 0 0 0 0 0 0 0999 V2000
  11781. -0.2702 -1.1168 0.2852 C 0 0 0 0 0 0 0 0 0 0 0 0
  11782. -1.2785 -0.1860 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
  11783. -0.9129 1.1090 -0.2731 C 0 0 0 0 0 0 0 0 0 0 0 0
  11784. 0.3682 1.5219 -0.3887 N 0 0 0 0 0 0 0 0 0 0 0 0
  11785. 1.3253 0.5959 -0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0
  11786. 1.0589 -0.7219 0.1738 C 0 0 0 0 0 0 0 0 0 0 0 0
  11787. -0.5180 -2.1414 0.5469 H 0 0 0 0 0 0 0 0 0 0 0 0
  11788. -2.3238 -0.4620 0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0
  11789. -1.6631 1.8719 -0.4599 H 0 0 0 0 0 0 0 0 0 0 0 0
  11790. 2.3464 0.9526 -0.2613 H 0 0 0 0 0 0 0 0 0 0 0 0
  11791. 1.8678 -1.4231 0.3445 H 0 0 0 0 0 0 0 0 0 0 0 0
  11792. 1 2 2 0
  11793. 2 3 1 0
  11794. 3 4 2 0
  11795. 4 5 1 0
  11796. 5 6 2 0
  11797. 6 1 1 0
  11798. 1 7 1 0
  11799. 2 8 1 0
  11800. 3 9 1 0
  11801. 5 10 1 0
  11802. 6 11 1 0
  11803. M END
  11804. $$$$
  11805. RDKit 3D
  11806. 11 11 0 0 0 0 0 0 0 0999 V2000
  11807. -0.2702 -1.1186 0.2782 C 0 0 0 0 0 0 0 0 0 0 0 0
  11808. -1.2785 -0.1864 0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0
  11809. -0.9129 1.1107 -0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0
  11810. 0.3682 1.5243 -0.3791 N 0 0 0 0 0 0 0 0 0 0 0 0
  11811. 1.3253 0.5969 -0.1585 C 0 0 0 0 0 0 0 0 0 0 0 0
  11812. 1.0589 -0.7230 0.1693 C 0 0 0 0 0 0 0 0 0 0 0 0
  11813. -0.5180 -2.1448 0.5334 H 0 0 0 0 0 0 0 0 0 0 0 0
  11814. -2.3238 -0.4629 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
  11815. -1.6631 1.8747 -0.4482 H 0 0 0 0 0 0 0 0 0 0 0 0
  11816. 2.3464 0.9542 -0.2554 H 0 0 0 0 0 0 0 0 0 0 0 0
  11817. 1.8678 -1.4252 0.3356 H 0 0 0 0 0 0 0 0 0 0 0 0
  11818. 1 2 2 0
  11819. 2 3 1 0
  11820. 3 4 2 0
  11821. 4 5 1 0
  11822. 5 6 2 0
  11823. 6 1 1 0
  11824. 1 7 1 0
  11825. 2 8 1 0
  11826. 3 9 1 0
  11827. 5 10 1 0
  11828. 6 11 1 0
  11829. M END
  11830. $$$$
  11831. RDKit 3D
  11832. 11 11 0 0 0 0 0 0 0 0999 V2000
  11833. -0.2702 -1.1203 0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0
  11834. -1.2785 -0.1867 0.0557 C 0 0 0 0 0 0 0 0 0 0 0 0
  11835. -0.9129 1.1124 -0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0
  11836. 0.3682 1.5266 -0.3695 N 0 0 0 0 0 0 0 0 0 0 0 0
  11837. 1.3253 0.5979 -0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0
  11838. 1.0589 -0.7240 0.1647 C 0 0 0 0 0 0 0 0 0 0 0 0
  11839. -0.5180 -2.1481 0.5199 H 0 0 0 0 0 0 0 0 0 0 0 0
  11840. -2.3238 -0.4637 0.1311 H 0 0 0 0 0 0 0 0 0 0 0 0
  11841. -1.6631 1.8775 -0.4364 H 0 0 0 0 0 0 0 0 0 0 0 0
  11842. 2.3464 0.9558 -0.2494 H 0 0 0 0 0 0 0 0 0 0 0 0
  11843. 1.8678 -1.4273 0.3266 H 0 0 0 0 0 0 0 0 0 0 0 0
  11844. 1 2 2 0
  11845. 2 3 1 0
  11846. 3 4 2 0
  11847. 4 5 1 0
  11848. 5 6 2 0
  11849. 6 1 1 0
  11850. 1 7 1 0
  11851. 2 8 1 0
  11852. 3 9 1 0
  11853. 5 10 1 0
  11854. 6 11 1 0
  11855. M END
  11856. $$$$
  11857. RDKit 3D
  11858. 11 11 0 0 0 0 0 0 0 0999 V2000
  11859. -0.2702 -1.1220 0.2641 C 0 0 0 0 0 0 0 0 0 0 0 0
  11860. -1.2785 -0.1871 0.0545 C 0 0 0 0 0 0 0 0 0 0 0 0
  11861. -0.9129 1.1140 -0.2522 C 0 0 0 0 0 0 0 0 0 0 0 0
  11862. 0.3682 1.5289 -0.3599 N 0 0 0 0 0 0 0 0 0 0 0 0
  11863. 1.3253 0.5988 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  11864. 1.0589 -0.7251 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0
  11865. -0.5180 -2.1513 0.5064 H 0 0 0 0 0 0 0 0 0 0 0 0
  11866. -2.3238 -0.4645 0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0
  11867. -1.6631 1.8802 -0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0
  11868. 2.3464 0.9573 -0.2433 H 0 0 0 0 0 0 0 0 0 0 0 0
  11869. 1.8678 -1.4293 0.3176 H 0 0 0 0 0 0 0 0 0 0 0 0
  11870. 1 2 2 0
  11871. 2 3 1 0
  11872. 3 4 2 0
  11873. 4 5 1 0
  11874. 5 6 2 0
  11875. 6 1 1 0
  11876. 1 7 1 0
  11877. 2 8 1 0
  11878. 3 9 1 0
  11879. 5 10 1 0
  11880. 6 11 1 0
  11881. M END
  11882. $$$$
  11883. RDKit 3D
  11884. 11 11 0 0 0 0 0 0 0 0999 V2000
  11885. -0.2702 -1.1236 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  11886. -1.2785 -0.1874 0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0
  11887. -0.9129 1.1155 -0.2452 C 0 0 0 0 0 0 0 0 0 0 0 0
  11888. 0.3682 1.5312 -0.3503 N 0 0 0 0 0 0 0 0 0 0 0 0
  11889. 1.3253 0.5998 -0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0
  11890. 1.0589 -0.7261 0.1556 C 0 0 0 0 0 0 0 0 0 0 0 0
  11891. -0.5180 -2.1544 0.4929 H 0 0 0 0 0 0 0 0 0 0 0 0
  11892. -2.3238 -0.4653 0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0
  11893. -1.6631 1.8828 -0.4128 H 0 0 0 0 0 0 0 0 0 0 0 0
  11894. 2.3464 0.9589 -0.2373 H 0 0 0 0 0 0 0 0 0 0 0 0
  11895. 1.8678 -1.4313 0.3086 H 0 0 0 0 0 0 0 0 0 0 0 0
  11896. 1 2 2 0
  11897. 2 3 1 0
  11898. 3 4 2 0
  11899. 4 5 1 0
  11900. 5 6 2 0
  11901. 6 1 1 0
  11902. 1 7 1 0
  11903. 2 8 1 0
  11904. 3 9 1 0
  11905. 5 10 1 0
  11906. 6 11 1 0
  11907. M END
  11908. $$$$
  11909. RDKit 3D
  11910. 11 11 0 0 0 0 0 0 0 0999 V2000
  11911. -0.2702 -1.1252 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0
  11912. -1.2785 -0.1877 0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0
  11913. -0.9129 1.1170 -0.2382 C 0 0 0 0 0 0 0 0 0 0 0 0
  11914. 0.3682 1.5333 -0.3407 N 0 0 0 0 0 0 0 0 0 0 0 0
  11915. 1.3253 0.6007 -0.1435 C 0 0 0 0 0 0 0 0 0 0 0 0
  11916. 1.0589 -0.7270 0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0
  11917. -0.5180 -2.1575 0.4793 H 0 0 0 0 0 0 0 0 0 0 0 0
  11918. -2.3238 -0.4661 0.1223 H 0 0 0 0 0 0 0 0 0 0 0 0
  11919. -1.6631 1.8854 -0.4009 H 0 0 0 0 0 0 0 0 0 0 0 0
  11920. 2.3464 0.9603 -0.2313 H 0 0 0 0 0 0 0 0 0 0 0 0
  11921. 1.8678 -1.4332 0.2997 H 0 0 0 0 0 0 0 0 0 0 0 0
  11922. 1 2 2 0
  11923. 2 3 1 0
  11924. 3 4 2 0
  11925. 4 5 1 0
  11926. 5 6 2 0
  11927. 6 1 1 0
  11928. 1 7 1 0
  11929. 2 8 1 0
  11930. 3 9 1 0
  11931. 5 10 1 0
  11932. 6 11 1 0
  11933. M END
  11934. $$$$
  11935. RDKit 3D
  11936. 11 11 0 0 0 0 0 0 0 0999 V2000
  11937. -0.2702 -1.1268 0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0
  11938. -1.2785 -0.1881 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0
  11939. -0.9129 1.1185 -0.2311 C 0 0 0 0 0 0 0 0 0 0 0 0
  11940. 0.3682 1.5355 -0.3310 N 0 0 0 0 0 0 0 0 0 0 0 0
  11941. 1.3253 0.6016 -0.1397 C 0 0 0 0 0 0 0 0 0 0 0 0
  11942. 1.0589 -0.7280 0.1465 C 0 0 0 0 0 0 0 0 0 0 0 0
  11943. -0.5180 -2.1605 0.4658 H 0 0 0 0 0 0 0 0 0 0 0 0
  11944. -2.3238 -0.4669 0.1194 H 0 0 0 0 0 0 0 0 0 0 0 0
  11945. -1.6631 1.8879 -0.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
  11946. 2.3464 0.9618 -0.2253 H 0 0 0 0 0 0 0 0 0 0 0 0
  11947. 1.8678 -1.4350 0.2906 H 0 0 0 0 0 0 0 0 0 0 0 0
  11948. 1 2 2 0
  11949. 2 3 1 0
  11950. 3 4 2 0
  11951. 4 5 1 0
  11952. 5 6 2 0
  11953. 6 1 1 0
  11954. 1 7 1 0
  11955. 2 8 1 0
  11956. 3 9 1 0
  11957. 5 10 1 0
  11958. 6 11 1 0
  11959. M END
  11960. $$$$
  11961. RDKit 3D
  11962. 11 11 0 0 0 0 0 0 0 0999 V2000
  11963. -0.2702 -1.1283 0.2358 C 0 0 0 0 0 0 0 0 0 0 0 0
  11964. -1.2785 -0.1884 0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
  11965. -0.9129 1.1200 -0.2241 C 0 0 0 0 0 0 0 0 0 0 0 0
  11966. 0.3682 1.5375 -0.3214 N 0 0 0 0 0 0 0 0 0 0 0 0
  11967. 1.3253 0.6024 -0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
  11968. 1.0589 -0.7289 0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  11969. -0.5180 -2.1634 0.4522 H 0 0 0 0 0 0 0 0 0 0 0 0
  11970. -2.3238 -0.4676 0.1164 H 0 0 0 0 0 0 0 0 0 0 0 0
  11971. -1.6631 1.8903 -0.3772 H 0 0 0 0 0 0 0 0 0 0 0 0
  11972. 2.3464 0.9632 -0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0
  11973. 1.8678 -1.4368 0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0
  11974. 1 2 2 0
  11975. 2 3 1 0
  11976. 3 4 2 0
  11977. 4 5 1 0
  11978. 5 6 2 0
  11979. 6 1 1 0
  11980. 1 7 1 0
  11981. 2 8 1 0
  11982. 3 9 1 0
  11983. 5 10 1 0
  11984. 6 11 1 0
  11985. M END
  11986. $$$$
  11987. RDKit 3D
  11988. 11 11 0 0 0 0 0 0 0 0999 V2000
  11989. -0.2702 -1.1297 0.2287 C 0 0 0 0 0 0 0 0 0 0 0 0
  11990. -1.2785 -0.1887 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0
  11991. -0.9129 1.1213 -0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0
  11992. 0.3682 1.5395 -0.3117 N 0 0 0 0 0 0 0 0 0 0 0 0
  11993. 1.3253 0.6033 -0.1321 C 0 0 0 0 0 0 0 0 0 0 0 0
  11994. 1.0589 -0.7297 0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0
  11995. -0.5180 -2.1662 0.4386 H 0 0 0 0 0 0 0 0 0 0 0 0
  11996. -2.3238 -0.4683 0.1135 H 0 0 0 0 0 0 0 0 0 0 0 0
  11997. -1.6631 1.8926 -0.3653 H 0 0 0 0 0 0 0 0 0 0 0 0
  11998. 2.3464 0.9645 -0.2132 H 0 0 0 0 0 0 0 0 0 0 0 0
  11999. 1.8678 -1.4386 0.2726 H 0 0 0 0 0 0 0 0 0 0 0 0
  12000. 1 2 2 0
  12001. 2 3 1 0
  12002. 3 4 2 0
  12003. 4 5 1 0
  12004. 5 6 2 0
  12005. 6 1 1 0
  12006. 1 7 1 0
  12007. 2 8 1 0
  12008. 3 9 1 0
  12009. 5 10 1 0
  12010. 6 11 1 0
  12011. M END
  12012. $$$$
  12013. RDKit 3D
  12014. 11 11 0 0 0 0 0 0 0 0999 V2000
  12015. -0.2702 -1.1311 0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0
  12016. -1.2785 -0.1890 0.0474 C 0 0 0 0 0 0 0 0 0 0 0 0
  12017. -0.9129 1.1227 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0
  12018. 0.3682 1.5414 -0.3020 N 0 0 0 0 0 0 0 0 0 0 0 0
  12019. 1.3253 0.6041 -0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0
  12020. 1.0589 -0.7306 0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0
  12021. -0.5180 -2.1689 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0
  12022. -2.3238 -0.4690 0.1106 H 0 0 0 0 0 0 0 0 0 0 0 0
  12023. -1.6631 1.8949 -0.3534 H 0 0 0 0 0 0 0 0 0 0 0 0
  12024. 2.3464 0.9658 -0.2071 H 0 0 0 0 0 0 0 0 0 0 0 0
  12025. 1.8678 -1.4403 0.2635 H 0 0 0 0 0 0 0 0 0 0 0 0
  12026. 1 2 2 0
  12027. 2 3 1 0
  12028. 3 4 2 0
  12029. 4 5 1 0
  12030. 5 6 2 0
  12031. 6 1 1 0
  12032. 1 7 1 0
  12033. 2 8 1 0
  12034. 3 9 1 0
  12035. 5 10 1 0
  12036. 6 11 1 0
  12037. M END
  12038. $$$$
  12039. RDKit 3D
  12040. 11 11 0 0 0 0 0 0 0 0999 V2000
  12041. -0.2702 -1.1325 0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0
  12042. -1.2785 -0.1893 0.0462 C 0 0 0 0 0 0 0 0 0 0 0 0
  12043. -0.9129 1.1240 -0.2029 C 0 0 0 0 0 0 0 0 0 0 0 0
  12044. 0.3682 1.5433 -0.2923 N 0 0 0 0 0 0 0 0 0 0 0 0
  12045. 1.3253 0.6049 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0
  12046. 1.0589 -0.7314 0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0
  12047. -0.5180 -2.1715 0.4113 H 0 0 0 0 0 0 0 0 0 0 0 0
  12048. -2.3238 -0.4697 0.1076 H 0 0 0 0 0 0 0 0 0 0 0 0
  12049. -1.6631 1.8970 -0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0
  12050. 2.3464 0.9671 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0
  12051. 1.8678 -1.4419 0.2545 H 0 0 0 0 0 0 0 0 0 0 0 0
  12052. 1 2 2 0
  12053. 2 3 1 0
  12054. 3 4 2 0
  12055. 4 5 1 0
  12056. 5 6 2 0
  12057. 6 1 1 0
  12058. 1 7 1 0
  12059. 2 8 1 0
  12060. 3 9 1 0
  12061. 5 10 1 0
  12062. 6 11 1 0
  12063. M END
  12064. $$$$
  12065. RDKit 3D
  12066. 11 11 0 0 0 0 0 0 0 0999 V2000
  12067. -0.2702 -1.1338 0.2074 C 0 0 0 0 0 0 0 0 0 0 0 0
  12068. -1.2785 -0.1896 0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0
  12069. -0.9129 1.1252 -0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0
  12070. 0.3682 1.5451 -0.2826 N 0 0 0 0 0 0 0 0 0 0 0 0
  12071. 1.3253 0.6056 -0.1207 C 0 0 0 0 0 0 0 0 0 0 0 0
  12072. 1.0589 -0.7322 0.1236 C 0 0 0 0 0 0 0 0 0 0 0 0
  12073. -0.5180 -2.1740 0.3977 H 0 0 0 0 0 0 0 0 0 0 0 0
  12074. -2.3238 -0.4704 0.1047 H 0 0 0 0 0 0 0 0 0 0 0 0
  12075. -1.6631 1.8992 -0.3296 H 0 0 0 0 0 0 0 0 0 0 0 0
  12076. 2.3464 0.9684 -0.1949 H 0 0 0 0 0 0 0 0 0 0 0 0
  12077. 1.8678 -1.4435 0.2454 H 0 0 0 0 0 0 0 0 0 0 0 0
  12078. 1 2 2 0
  12079. 2 3 1 0
  12080. 3 4 2 0
  12081. 4 5 1 0
  12082. 5 6 2 0
  12083. 6 1 1 0
  12084. 1 7 1 0
  12085. 2 8 1 0
  12086. 3 9 1 0
  12087. 5 10 1 0
  12088. 6 11 1 0
  12089. M END
  12090. $$$$
  12091. RDKit 3D
  12092. 11 11 0 0 0 0 0 0 0 0999 V2000
  12093. -0.2702 -1.1351 0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0
  12094. -1.2785 -0.1899 0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0
  12095. -0.9129 1.1264 -0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0
  12096. 0.3682 1.5468 -0.2729 N 0 0 0 0 0 0 0 0 0 0 0 0
  12097. 1.3253 0.6064 -0.1169 C 0 0 0 0 0 0 0 0 0 0 0 0
  12098. 1.0589 -0.7330 0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0
  12099. -0.5180 -2.1765 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0
  12100. -2.3238 -0.4710 0.1017 H 0 0 0 0 0 0 0 0 0 0 0 0
  12101. -1.6631 1.9012 -0.3176 H 0 0 0 0 0 0 0 0 0 0 0 0
  12102. 2.3464 0.9696 -0.1888 H 0 0 0 0 0 0 0 0 0 0 0 0
  12103. 1.8678 -1.4450 0.2363 H 0 0 0 0 0 0 0 0 0 0 0 0
  12104. 1 2 2 0
  12105. 2 3 1 0
  12106. 3 4 2 0
  12107. 4 5 1 0
  12108. 5 6 2 0
  12109. 6 1 1 0
  12110. 1 7 1 0
  12111. 2 8 1 0
  12112. 3 9 1 0
  12113. 5 10 1 0
  12114. 6 11 1 0
  12115. M END
  12116. $$$$
  12117. RDKit 3D
  12118. 11 11 0 0 0 0 0 0 0 0999 V2000
  12119. -0.2702 -1.1363 0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0
  12120. -1.2785 -0.1901 0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0
  12121. -0.9129 1.1276 -0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0
  12122. 0.3682 1.5485 -0.2632 N 0 0 0 0 0 0 0 0 0 0 0 0
  12123. 1.3253 0.6071 -0.1131 C 0 0 0 0 0 0 0 0 0 0 0 0
  12124. 1.0589 -0.7337 0.1143 C 0 0 0 0 0 0 0 0 0 0 0 0
  12125. -0.5180 -2.1789 0.3703 H 0 0 0 0 0 0 0 0 0 0 0 0
  12126. -2.3238 -0.4717 0.0987 H 0 0 0 0 0 0 0 0 0 0 0 0
  12127. -1.6631 1.9031 -0.3057 H 0 0 0 0 0 0 0 0 0 0 0 0
  12128. 2.3464 0.9707 -0.1828 H 0 0 0 0 0 0 0 0 0 0 0 0
  12129. 1.8678 -1.4464 0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0
  12130. 1 2 2 0
  12131. 2 3 1 0
  12132. 3 4 2 0
  12133. 4 5 1 0
  12134. 5 6 2 0
  12135. 6 1 1 0
  12136. 1 7 1 0
  12137. 2 8 1 0
  12138. 3 9 1 0
  12139. 5 10 1 0
  12140. 6 11 1 0
  12141. M END
  12142. $$$$
  12143. RDKit 3D
  12144. 11 11 0 0 0 0 0 0 0 0999 V2000
  12145. -0.2702 -1.1375 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  12146. -1.2785 -0.1904 0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0
  12147. -0.9129 1.1287 -0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
  12148. 0.3682 1.5501 -0.2535 N 0 0 0 0 0 0 0 0 0 0 0 0
  12149. 1.3253 0.6078 -0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0
  12150. 1.0589 -0.7344 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0
  12151. -0.5180 -2.1811 0.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
  12152. -2.3238 -0.4723 0.0958 H 0 0 0 0 0 0 0 0 0 0 0 0
  12153. -1.6631 1.9050 -0.2937 H 0 0 0 0 0 0 0 0 0 0 0 0
  12154. 2.3464 0.9719 -0.1766 H 0 0 0 0 0 0 0 0 0 0 0 0
  12155. 1.8678 -1.4478 0.2182 H 0 0 0 0 0 0 0 0 0 0 0 0
  12156. 1 2 2 0
  12157. 2 3 1 0
  12158. 3 4 2 0
  12159. 4 5 1 0
  12160. 5 6 2 0
  12161. 6 1 1 0
  12162. 1 7 1 0
  12163. 2 8 1 0
  12164. 3 9 1 0
  12165. 5 10 1 0
  12166. 6 11 1 0
  12167. M END
  12168. $$$$
  12169. RDKit 3D
  12170. 11 11 0 0 0 0 0 0 0 0999 V2000
  12171. -0.2702 -1.1387 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0
  12172. -1.2785 -0.1906 0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0
  12173. -0.9129 1.1298 -0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0
  12174. 0.3682 1.5517 -0.2437 N 0 0 0 0 0 0 0 0 0 0 0 0
  12175. 1.3253 0.6085 -0.1055 C 0 0 0 0 0 0 0 0 0 0 0 0
  12176. 1.0589 -0.7351 0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0
  12177. -0.5180 -2.1833 0.3429 H 0 0 0 0 0 0 0 0 0 0 0 0
  12178. -2.3238 -0.4729 0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0
  12179. -1.6631 1.9068 -0.2817 H 0 0 0 0 0 0 0 0 0 0 0 0
  12180. 2.3464 0.9730 -0.1705 H 0 0 0 0 0 0 0 0 0 0 0 0
  12181. 1.8678 -1.4492 0.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
  12182. 1 2 2 0
  12183. 2 3 1 0
  12184. 3 4 2 0
  12185. 4 5 1 0
  12186. 5 6 2 0
  12187. 6 1 1 0
  12188. 1 7 1 0
  12189. 2 8 1 0
  12190. 3 9 1 0
  12191. 5 10 1 0
  12192. 6 11 1 0
  12193. M END
  12194. $$$$
  12195. RDKit 3D
  12196. 11 11 0 0 0 0 0 0 0 0999 V2000
  12197. -0.2702 -1.1398 0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0
  12198. -1.2785 -0.1909 0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0
  12199. -0.9129 1.1308 -0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0
  12200. 0.3682 1.5532 -0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0
  12201. 1.3253 0.6091 -0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0
  12202. 1.0589 -0.7357 0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0
  12203. -0.5180 -2.1855 0.3292 H 0 0 0 0 0 0 0 0 0 0 0 0
  12204. -2.3238 -0.4735 0.0898 H 0 0 0 0 0 0 0 0 0 0 0 0
  12205. -1.6631 1.9086 -0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0
  12206. 2.3464 0.9740 -0.1644 H 0 0 0 0 0 0 0 0 0 0 0 0
  12207. 1.8678 -1.4504 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  12208. 1 2 2 0
  12209. 2 3 1 0
  12210. 3 4 2 0
  12211. 4 5 1 0
  12212. 5 6 2 0
  12213. 6 1 1 0
  12214. 1 7 1 0
  12215. 2 8 1 0
  12216. 3 9 1 0
  12217. 5 10 1 0
  12218. 6 11 1 0
  12219. M END
  12220. $$$$
  12221. RDKit 3D
  12222. 11 11 0 0 0 0 0 0 0 0999 V2000
  12223. -0.2702 -1.1408 0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0
  12224. -1.2785 -0.1911 0.0379 C 0 0 0 0 0 0 0 0 0 0 0 0
  12225. -0.9129 1.1318 -0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0
  12226. 0.3682 1.5546 -0.2242 N 0 0 0 0 0 0 0 0 0 0 0 0
  12227. 1.3253 0.6098 -0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0
  12228. 1.0589 -0.7363 0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
  12229. -0.5180 -2.1875 0.3154 H 0 0 0 0 0 0 0 0 0 0 0 0
  12230. -2.3238 -0.4740 0.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
  12231. -1.6631 1.9102 -0.2578 H 0 0 0 0 0 0 0 0 0 0 0 0
  12232. 2.3464 0.9750 -0.1583 H 0 0 0 0 0 0 0 0 0 0 0 0
  12233. 1.8678 -1.4517 0.1908 H 0 0 0 0 0 0 0 0 0 0 0 0
  12234. 1 2 2 0
  12235. 2 3 1 0
  12236. 3 4 2 0
  12237. 4 5 1 0
  12238. 5 6 2 0
  12239. 6 1 1 0
  12240. 1 7 1 0
  12241. 2 8 1 0
  12242. 3 9 1 0
  12243. 5 10 1 0
  12244. 6 11 1 0
  12245. M END
  12246. $$$$
  12247. RDKit 3D
  12248. 11 11 0 0 0 0 0 0 0 0999 V2000
  12249. -0.2702 -1.1419 0.1573 C 0 0 0 0 0 0 0 0 0 0 0 0
  12250. -1.2785 -0.1914 0.0367 C 0 0 0 0 0 0 0 0 0 0 0 0
  12251. -0.9129 1.1328 -0.1462 C 0 0 0 0 0 0 0 0 0 0 0 0
  12252. 0.3682 1.5560 -0.2144 N 0 0 0 0 0 0 0 0 0 0 0 0
  12253. 1.3253 0.6104 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
  12254. 1.0589 -0.7369 0.0912 C 0 0 0 0 0 0 0 0 0 0 0 0
  12255. -0.5180 -2.1894 0.3017 H 0 0 0 0 0 0 0 0 0 0 0 0
  12256. -2.3238 -0.4745 0.0839 H 0 0 0 0 0 0 0 0 0 0 0 0
  12257. -1.6631 1.9118 -0.2458 H 0 0 0 0 0 0 0 0 0 0 0 0
  12258. 2.3464 0.9760 -0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0
  12259. 1.8678 -1.4528 0.1817 H 0 0 0 0 0 0 0 0 0 0 0 0
  12260. 1 2 2 0
  12261. 2 3 1 0
  12262. 3 4 2 0
  12263. 4 5 1 0
  12264. 5 6 2 0
  12265. 6 1 1 0
  12266. 1 7 1 0
  12267. 2 8 1 0
  12268. 3 9 1 0
  12269. 5 10 1 0
  12270. 6 11 1 0
  12271. M END
  12272. $$$$
  12273. RDKit 3D
  12274. 11 11 0 0 0 0 0 0 0 0999 V2000
  12275. -0.2702 -1.1428 0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0
  12276. -1.2785 -0.1916 0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0
  12277. -0.9129 1.1337 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
  12278. 0.3682 1.5573 -0.2046 N 0 0 0 0 0 0 0 0 0 0 0 0
  12279. 1.3253 0.6109 -0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
  12280. 1.0589 -0.7375 0.0866 C 0 0 0 0 0 0 0 0 0 0 0 0
  12281. -0.5180 -2.1913 0.2879 H 0 0 0 0 0 0 0 0 0 0 0 0
  12282. -2.3238 -0.4751 0.0809 H 0 0 0 0 0 0 0 0 0 0 0 0
  12283. -1.6631 1.9133 -0.2337 H 0 0 0 0 0 0 0 0 0 0 0 0
  12284. 2.3464 0.9769 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  12285. 1.8678 -1.4540 0.1726 H 0 0 0 0 0 0 0 0 0 0 0 0
  12286. 1 2 2 0
  12287. 2 3 1 0
  12288. 3 4 2 0
  12289. 4 5 1 0
  12290. 5 6 2 0
  12291. 6 1 1 0
  12292. 1 7 1 0
  12293. 2 8 1 0
  12294. 3 9 1 0
  12295. 5 10 1 0
  12296. 6 11 1 0
  12297. M END
  12298. $$$$
  12299. RDKit 3D
  12300. 11 11 0 0 0 0 0 0 0 0999 V2000
  12301. -0.2702 -1.1437 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0
  12302. -1.2785 -0.1918 0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0
  12303. -0.9129 1.1345 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0
  12304. 0.3682 1.5586 -0.1948 N 0 0 0 0 0 0 0 0 0 0 0 0
  12305. 1.3253 0.6115 -0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0
  12306. 1.0589 -0.7380 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  12307. -0.5180 -2.1930 0.2742 H 0 0 0 0 0 0 0 0 0 0 0 0
  12308. -2.3238 -0.4756 0.0779 H 0 0 0 0 0 0 0 0 0 0 0 0
  12309. -1.6631 1.9147 -0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0
  12310. 2.3464 0.9778 -0.1399 H 0 0 0 0 0 0 0 0 0 0 0 0
  12311. 1.8678 -1.4550 0.1634 H 0 0 0 0 0 0 0 0 0 0 0 0
  12312. 1 2 2 0
  12313. 2 3 1 0
  12314. 3 4 2 0
  12315. 4 5 1 0
  12316. 5 6 2 0
  12317. 6 1 1 0
  12318. 1 7 1 0
  12319. 2 8 1 0
  12320. 3 9 1 0
  12321. 5 10 1 0
  12322. 6 11 1 0
  12323. M END
  12324. $$$$
  12325. RDKit 3D
  12326. 11 11 0 0 0 0 0 0 0 0999 V2000
  12327. -0.2702 -1.1446 0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0
  12328. -1.2785 -0.1920 0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0
  12329. -0.9129 1.1353 -0.1248 C 0 0 0 0 0 0 0 0 0 0 0 0
  12330. 0.3682 1.5598 -0.1850 N 0 0 0 0 0 0 0 0 0 0 0 0
  12331. 1.3253 0.6120 -0.0825 C 0 0 0 0 0 0 0 0 0 0 0 0
  12332. 1.0589 -0.7385 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0
  12333. -0.5180 -2.1947 0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0
  12334. -2.3238 -0.4760 0.0749 H 0 0 0 0 0 0 0 0 0 0 0 0
  12335. -1.6631 1.9161 -0.2097 H 0 0 0 0 0 0 0 0 0 0 0 0
  12336. 2.3464 0.9787 -0.1337 H 0 0 0 0 0 0 0 0 0 0 0 0
  12337. 1.8678 -1.4560 0.1543 H 0 0 0 0 0 0 0 0 0 0 0 0
  12338. 1 2 2 0
  12339. 2 3 1 0
  12340. 3 4 2 0
  12341. 4 5 1 0
  12342. 5 6 2 0
  12343. 6 1 1 0
  12344. 1 7 1 0
  12345. 2 8 1 0
  12346. 3 9 1 0
  12347. 5 10 1 0
  12348. 6 11 1 0
  12349. M END
  12350. $$$$
  12351. RDKit 3D
  12352. 11 11 0 0 0 0 0 0 0 0999 V2000
  12353. -0.2702 -1.1454 0.1286 C 0 0 0 0 0 0 0 0 0 0 0 0
  12354. -1.2785 -0.1922 0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0
  12355. -0.9129 1.1361 -0.1177 C 0 0 0 0 0 0 0 0 0 0 0 0
  12356. 0.3682 1.5609 -0.1752 N 0 0 0 0 0 0 0 0 0 0 0 0
  12357. 1.3253 0.6125 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0
  12358. 1.0589 -0.7390 0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0
  12359. -0.5180 -2.1963 0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0
  12360. -2.3238 -0.4765 0.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
  12361. -1.6631 1.9174 -0.1976 H 0 0 0 0 0 0 0 0 0 0 0 0
  12362. 2.3464 0.9795 -0.1276 H 0 0 0 0 0 0 0 0 0 0 0 0
  12363. 1.8678 -1.4570 0.1452 H 0 0 0 0 0 0 0 0 0 0 0 0
  12364. 1 2 2 0
  12365. 2 3 1 0
  12366. 3 4 2 0
  12367. 4 5 1 0
  12368. 5 6 2 0
  12369. 6 1 1 0
  12370. 1 7 1 0
  12371. 2 8 1 0
  12372. 3 9 1 0
  12373. 5 10 1 0
  12374. 6 11 1 0
  12375. M END
  12376. $$$$
  12377. RDKit 3D
  12378. 11 11 0 0 0 0 0 0 0 0999 V2000
  12379. -0.2702 -1.1462 0.1214 C 0 0 0 0 0 0 0 0 0 0 0 0
  12380. -1.2785 -0.1924 0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0
  12381. -0.9129 1.1368 -0.1106 C 0 0 0 0 0 0 0 0 0 0 0 0
  12382. 0.3682 1.5620 -0.1654 N 0 0 0 0 0 0 0 0 0 0 0 0
  12383. 1.3253 0.6130 -0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
  12384. 1.0589 -0.7394 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0
  12385. -0.5180 -2.1978 0.2328 H 0 0 0 0 0 0 0 0 0 0 0 0
  12386. -2.3238 -0.4769 0.0689 H 0 0 0 0 0 0 0 0 0 0 0 0
  12387. -1.6631 1.9186 -0.1856 H 0 0 0 0 0 0 0 0 0 0 0 0
  12388. 2.3464 0.9803 -0.1214 H 0 0 0 0 0 0 0 0 0 0 0 0
  12389. 1.8678 -1.4578 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0
  12390. 1 2 2 0
  12391. 2 3 1 0
  12392. 3 4 2 0
  12393. 4 5 1 0
  12394. 5 6 2 0
  12395. 6 1 1 0
  12396. 1 7 1 0
  12397. 2 8 1 0
  12398. 3 9 1 0
  12399. 5 10 1 0
  12400. 6 11 1 0
  12401. M END
  12402. $$$$
  12403. RDKit 3D
  12404. 11 11 0 0 0 0 0 0 0 0999 V2000
  12405. -0.2702 -1.1470 0.1142 C 0 0 0 0 0 0 0 0 0 0 0 0
  12406. -1.2785 -0.1926 0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0
  12407. -0.9129 1.1375 -0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
  12408. 0.3682 1.5630 -0.1556 N 0 0 0 0 0 0 0 0 0 0 0 0
  12409. 1.3253 0.6135 -0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0
  12410. 1.0589 -0.7398 0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
  12411. -0.5180 -2.1992 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0
  12412. -2.3238 -0.4774 0.0659 H 0 0 0 0 0 0 0 0 0 0 0 0
  12413. -1.6631 1.9197 -0.1735 H 0 0 0 0 0 0 0 0 0 0 0 0
  12414. 2.3464 0.9810 -0.1153 H 0 0 0 0 0 0 0 0 0 0 0 0
  12415. 1.8678 -1.4587 0.1268 H 0 0 0 0 0 0 0 0 0 0 0 0
  12416. 1 2 2 0
  12417. 2 3 1 0
  12418. 3 4 2 0
  12419. 4 5 1 0
  12420. 5 6 2 0
  12421. 6 1 1 0
  12422. 1 7 1 0
  12423. 2 8 1 0
  12424. 3 9 1 0
  12425. 5 10 1 0
  12426. 6 11 1 0
  12427. M END
  12428. $$$$
  12429. RDKit 3D
  12430. 11 11 0 0 0 0 0 0 0 0999 V2000
  12431. -0.2702 -1.1477 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  12432. -1.2785 -0.1928 0.0282 C 0 0 0 0 0 0 0 0 0 0 0 0
  12433. -0.9129 1.1381 -0.0963 C 0 0 0 0 0 0 0 0 0 0 0 0
  12434. 0.3682 1.5639 -0.1458 N 0 0 0 0 0 0 0 0 0 0 0 0
  12435. 1.3253 0.6139 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0
  12436. 1.0589 -0.7402 0.0587 C 0 0 0 0 0 0 0 0 0 0 0 0
  12437. -0.5180 -2.2006 0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0
  12438. -2.3238 -0.4778 0.0629 H 0 0 0 0 0 0 0 0 0 0 0 0
  12439. -1.6631 1.9208 -0.1615 H 0 0 0 0 0 0 0 0 0 0 0 0
  12440. 2.3464 0.9817 -0.1091 H 0 0 0 0 0 0 0 0 0 0 0 0
  12441. 1.8678 -1.4594 0.1177 H 0 0 0 0 0 0 0 0 0 0 0 0
  12442. 1 2 2 0
  12443. 2 3 1 0
  12444. 3 4 2 0
  12445. 4 5 1 0
  12446. 5 6 2 0
  12447. 6 1 1 0
  12448. 1 7 1 0
  12449. 2 8 1 0
  12450. 3 9 1 0
  12451. 5 10 1 0
  12452. 6 11 1 0
  12453. M END
  12454. $$$$
  12455. RDKit 3D
  12456. 11 11 0 0 0 0 0 0 0 0999 V2000
  12457. -0.2702 -1.1483 0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0
  12458. -1.2785 -0.1930 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0
  12459. -0.9129 1.1387 -0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0
  12460. 0.3682 1.5648 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0
  12461. 1.3253 0.6143 -0.0632 C 0 0 0 0 0 0 0 0 0 0 0 0
  12462. 1.0589 -0.7406 0.0541 C 0 0 0 0 0 0 0 0 0 0 0 0
  12463. -0.5180 -2.2018 0.1913 H 0 0 0 0 0 0 0 0 0 0 0 0
  12464. -2.3238 -0.4782 0.0599 H 0 0 0 0 0 0 0 0 0 0 0 0
  12465. -1.6631 1.9217 -0.1494 H 0 0 0 0 0 0 0 0 0 0 0 0
  12466. 2.3464 0.9824 -0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0
  12467. 1.8678 -1.4601 0.1085 H 0 0 0 0 0 0 0 0 0 0 0 0
  12468. 1 2 2 0
  12469. 2 3 1 0
  12470. 3 4 2 0
  12471. 4 5 1 0
  12472. 5 6 2 0
  12473. 6 1 1 0
  12474. 1 7 1 0
  12475. 2 8 1 0
  12476. 3 9 1 0
  12477. 5 10 1 0
  12478. 6 11 1 0
  12479. M END
  12480. $$$$
  12481. RDKit 3D
  12482. 11 11 0 0 0 0 0 0 0 0999 V2000
  12483. -0.2702 -1.1489 0.0926 C 0 0 0 0 0 0 0 0 0 0 0 0
  12484. -1.2785 -0.1931 0.0258 C 0 0 0 0 0 0 0 0 0 0 0 0
  12485. -0.9129 1.1392 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  12486. 0.3682 1.5657 -0.1261 N 0 0 0 0 0 0 0 0 0 0 0 0
  12487. 1.3253 0.6147 -0.0593 C 0 0 0 0 0 0 0 0 0 0 0 0
  12488. 1.0589 -0.7409 0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0
  12489. -0.5180 -2.2030 0.1775 H 0 0 0 0 0 0 0 0 0 0 0 0
  12490. -2.3238 -0.4785 0.0569 H 0 0 0 0 0 0 0 0 0 0 0 0
  12491. -1.6631 1.9226 -0.1373 H 0 0 0 0 0 0 0 0 0 0 0 0
  12492. 2.3464 0.9830 -0.0968 H 0 0 0 0 0 0 0 0 0 0 0 0
  12493. 1.8678 -1.4608 0.0993 H 0 0 0 0 0 0 0 0 0 0 0 0
  12494. 1 2 2 0
  12495. 2 3 1 0
  12496. 3 4 2 0
  12497. 4 5 1 0
  12498. 5 6 2 0
  12499. 6 1 1 0
  12500. 1 7 1 0
  12501. 2 8 1 0
  12502. 3 9 1 0
  12503. 5 10 1 0
  12504. 6 11 1 0
  12505. M END
  12506. $$$$
  12507. RDKit 3D
  12508. 11 11 0 0 0 0 0 0 0 0999 V2000
  12509. -0.2702 -1.1495 0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0
  12510. -1.2785 -0.1933 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0
  12511. -0.9129 1.1397 -0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
  12512. 0.3682 1.5664 -0.1163 N 0 0 0 0 0 0 0 0 0 0 0 0
  12513. 1.3253 0.6151 -0.0555 C 0 0 0 0 0 0 0 0 0 0 0 0
  12514. 1.0589 -0.7412 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0
  12515. -0.5180 -2.2040 0.1636 H 0 0 0 0 0 0 0 0 0 0 0 0
  12516. -2.3238 -0.4789 0.0539 H 0 0 0 0 0 0 0 0 0 0 0 0
  12517. -1.6631 1.9235 -0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0
  12518. 2.3464 0.9836 -0.0906 H 0 0 0 0 0 0 0 0 0 0 0 0
  12519. 1.8678 -1.4614 0.0901 H 0 0 0 0 0 0 0 0 0 0 0 0
  12520. 1 2 2 0
  12521. 2 3 1 0
  12522. 3 4 2 0
  12523. 4 5 1 0
  12524. 5 6 2 0
  12525. 6 1 1 0
  12526. 1 7 1 0
  12527. 2 8 1 0
  12528. 3 9 1 0
  12529. 5 10 1 0
  12530. 6 11 1 0
  12531. M END
  12532. $$$$
  12533. RDKit 3D
  12534. 11 11 0 0 0 0 0 0 0 0999 V2000
  12535. -0.2702 -1.1500 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
  12536. -1.2785 -0.1934 0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0
  12537. -0.9129 1.1401 -0.0676 C 0 0 0 0 0 0 0 0 0 0 0 0
  12538. 0.3682 1.5671 -0.1064 N 0 0 0 0 0 0 0 0 0 0 0 0
  12539. 1.3253 0.6154 -0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0
  12540. 1.0589 -0.7415 0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0
  12541. -0.5180 -2.2050 0.1498 H 0 0 0 0 0 0 0 0 0 0 0 0
  12542. -2.3238 -0.4792 0.0509 H 0 0 0 0 0 0 0 0 0 0 0 0
  12543. -1.6631 1.9242 -0.1131 H 0 0 0 0 0 0 0 0 0 0 0 0
  12544. 2.3464 0.9842 -0.0844 H 0 0 0 0 0 0 0 0 0 0 0 0
  12545. 1.8678 -1.4619 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0
  12546. 1 2 2 0
  12547. 2 3 1 0
  12548. 3 4 2 0
  12549. 4 5 1 0
  12550. 5 6 2 0
  12551. 6 1 1 0
  12552. 1 7 1 0
  12553. 2 8 1 0
  12554. 3 9 1 0
  12555. 5 10 1 0
  12556. 6 11 1 0
  12557. M END
  12558. $$$$
  12559. RDKit 3D
  12560. 11 11 0 0 0 0 0 0 0 0999 V2000
  12561. -0.2702 -1.1505 0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0
  12562. -1.2785 -0.1936 0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0
  12563. -0.9129 1.1406 -0.0605 C 0 0 0 0 0 0 0 0 0 0 0 0
  12564. 0.3682 1.5678 -0.0966 N 0 0 0 0 0 0 0 0 0 0 0 0
  12565. 1.3253 0.6157 -0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0
  12566. 1.0589 -0.7417 0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0
  12567. -0.5180 -2.2059 0.1359 H 0 0 0 0 0 0 0 0 0 0 0 0
  12568. -2.3238 -0.4795 0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0
  12569. -1.6631 1.9249 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  12570. 2.3464 0.9847 -0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0
  12571. 1.8678 -1.4624 0.0718 H 0 0 0 0 0 0 0 0 0 0 0 0
  12572. 1 2 2 0
  12573. 2 3 1 0
  12574. 3 4 2 0
  12575. 4 5 1 0
  12576. 5 6 2 0
  12577. 6 1 1 0
  12578. 1 7 1 0
  12579. 2 8 1 0
  12580. 3 9 1 0
  12581. 5 10 1 0
  12582. 6 11 1 0
  12583. M END
  12584. $$$$
  12585. RDKit 3D
  12586. 11 11 0 0 0 0 0 0 0 0999 V2000
  12587. -0.2702 -1.1509 0.0637 C 0 0 0 0 0 0 0 0 0 0 0 0
  12588. -1.2785 -0.1937 0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0
  12589. -0.9129 1.1409 -0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0
  12590. 0.3682 1.5683 -0.0867 N 0 0 0 0 0 0 0 0 0 0 0 0
  12591. 1.3253 0.6160 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0
  12592. 1.0589 -0.7419 0.0308 C 0 0 0 0 0 0 0 0 0 0 0 0
  12593. -0.5180 -2.2067 0.1221 H 0 0 0 0 0 0 0 0 0 0 0 0
  12594. -2.3238 -0.4798 0.0449 H 0 0 0 0 0 0 0 0 0 0 0 0
  12595. -1.6631 1.9255 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0
  12596. 2.3464 0.9852 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0
  12597. 1.8678 -1.4628 0.0626 H 0 0 0 0 0 0 0 0 0 0 0 0
  12598. 1 2 2 0
  12599. 2 3 1 0
  12600. 3 4 2 0
  12601. 4 5 1 0
  12602. 5 6 2 0
  12603. 6 1 1 0
  12604. 1 7 1 0
  12605. 2 8 1 0
  12606. 3 9 1 0
  12607. 5 10 1 0
  12608. 6 11 1 0
  12609. M END
  12610. $$$$
  12611. RDKit 3D
  12612. 11 11 0 0 0 0 0 0 0 0999 V2000
  12613. -0.2702 -1.1513 0.0564 C 0 0 0 0 0 0 0 0 0 0 0 0
  12614. -1.2785 -0.1939 0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0
  12615. -0.9129 1.1412 -0.0461 C 0 0 0 0 0 0 0 0 0 0 0 0
  12616. 0.3682 1.5688 -0.0769 N 0 0 0 0 0 0 0 0 0 0 0 0
  12617. 1.3253 0.6163 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  12618. 1.0589 -0.7421 0.0261 C 0 0 0 0 0 0 0 0 0 0 0 0
  12619. -0.5180 -2.2075 0.1082 H 0 0 0 0 0 0 0 0 0 0 0 0
  12620. -2.3238 -0.4801 0.0419 H 0 0 0 0 0 0 0 0 0 0 0 0
  12621. -1.6631 1.9260 -0.0769 H 0 0 0 0 0 0 0 0 0 0 0 0
  12622. 2.3464 0.9856 -0.0658 H 0 0 0 0 0 0 0 0 0 0 0 0
  12623. 1.8678 -1.4632 0.0534 H 0 0 0 0 0 0 0 0 0 0 0 0
  12624. 1 2 2 0
  12625. 2 3 1 0
  12626. 3 4 2 0
  12627. 4 5 1 0
  12628. 5 6 2 0
  12629. 6 1 1 0
  12630. 1 7 1 0
  12631. 2 8 1 0
  12632. 3 9 1 0
  12633. 5 10 1 0
  12634. 6 11 1 0
  12635. M END
  12636. $$$$
  12637. RDKit 3D
  12638. 11 11 0 0 0 0 0 0 0 0999 V2000
  12639. -0.2702 -1.1516 0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0
  12640. -1.2785 -0.1940 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0
  12641. -0.9129 1.1415 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
  12642. 0.3682 1.5693 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0
  12643. 1.3253 0.6165 -0.0361 C 0 0 0 0 0 0 0 0 0 0 0 0
  12644. 1.0589 -0.7422 0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0
  12645. -0.5180 -2.2081 0.0943 H 0 0 0 0 0 0 0 0 0 0 0 0
  12646. -2.3238 -0.4803 0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0
  12647. -1.6631 1.9264 -0.0647 H 0 0 0 0 0 0 0 0 0 0 0 0
  12648. 2.3464 0.9860 -0.0596 H 0 0 0 0 0 0 0 0 0 0 0 0
  12649. 1.8678 -1.4635 0.0442 H 0 0 0 0 0 0 0 0 0 0 0 0
  12650. 1 2 2 0
  12651. 2 3 1 0
  12652. 3 4 2 0
  12653. 4 5 1 0
  12654. 5 6 2 0
  12655. 6 1 1 0
  12656. 1 7 1 0
  12657. 2 8 1 0
  12658. 3 9 1 0
  12659. 5 10 1 0
  12660. 6 11 1 0
  12661. M END
  12662. $$$$
  12663. RDKit 3D
  12664. 11 11 0 0 0 0 0 0 0 0999 V2000
  12665. -0.2702 -1.1519 0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0
  12666. -1.2785 -0.1941 0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0
  12667. -0.9129 1.1417 -0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0
  12668. 0.3682 1.5697 -0.0572 N 0 0 0 0 0 0 0 0 0 0 0 0
  12669. 1.3253 0.6167 -0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0
  12670. 1.0589 -0.7424 0.0168 C 0 0 0 0 0 0 0 0 0 0 0 0
  12671. -0.5180 -2.2086 0.0804 H 0 0 0 0 0 0 0 0 0 0 0 0
  12672. -2.3238 -0.4806 0.0358 H 0 0 0 0 0 0 0 0 0 0 0 0
  12673. -1.6631 1.9268 -0.0526 H 0 0 0 0 0 0 0 0 0 0 0 0
  12674. 2.3464 0.9863 -0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0
  12675. 1.8678 -1.4637 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
  12676. 1 2 2 0
  12677. 2 3 1 0
  12678. 3 4 2 0
  12679. 4 5 1 0
  12680. 5 6 2 0
  12681. 6 1 1 0
  12682. 1 7 1 0
  12683. 2 8 1 0
  12684. 3 9 1 0
  12685. 5 10 1 0
  12686. 6 11 1 0
  12687. M END
  12688. $$$$
  12689. RDKit 3D
  12690. 11 11 0 0 0 0 0 0 0 0999 V2000
  12691. -0.2702 -1.1521 0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0
  12692. -1.2785 -0.1942 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0
  12693. -0.9129 1.1419 -0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0
  12694. 0.3682 1.5700 -0.0473 N 0 0 0 0 0 0 0 0 0 0 0 0
  12695. 1.3253 0.6169 -0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0
  12696. 1.0589 -0.7424 0.0122 C 0 0 0 0 0 0 0 0 0 0 0 0
  12697. -0.5180 -2.2091 0.0666 H 0 0 0 0 0 0 0 0 0 0 0 0
  12698. -2.3238 -0.4808 0.0328 H 0 0 0 0 0 0 0 0 0 0 0 0
  12699. -1.6631 1.9271 -0.0405 H 0 0 0 0 0 0 0 0 0 0 0 0
  12700. 2.3464 0.9867 -0.0473 H 0 0 0 0 0 0 0 0 0 0 0 0
  12701. 1.8678 -1.4639 0.0258 H 0 0 0 0 0 0 0 0 0 0 0 0
  12702. 1 2 2 0
  12703. 2 3 1 0
  12704. 3 4 2 0
  12705. 4 5 1 0
  12706. 5 6 2 0
  12707. 6 1 1 0
  12708. 1 7 1 0
  12709. 2 8 1 0
  12710. 3 9 1 0
  12711. 5 10 1 0
  12712. 6 11 1 0
  12713. M END
  12714. $$$$
  12715. RDKit 3D
  12716. 11 11 0 0 0 0 0 0 0 0999 V2000
  12717. -0.2702 -1.1523 0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0
  12718. -1.2785 -0.1943 0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0
  12719. -0.9129 1.1420 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0
  12720. 0.3682 1.5703 -0.0374 N 0 0 0 0 0 0 0 0 0 0 0 0
  12721. 1.3253 0.6171 -0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0
  12722. 1.0589 -0.7425 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0
  12723. -0.5180 -2.2095 0.0527 H 0 0 0 0 0 0 0 0 0 0 0 0
  12724. -2.3238 -0.4810 0.0298 H 0 0 0 0 0 0 0 0 0 0 0 0
  12725. -1.6631 1.9273 -0.0284 H 0 0 0 0 0 0 0 0 0 0 0 0
  12726. 2.3464 0.9869 -0.0411 H 0 0 0 0 0 0 0 0 0 0 0 0
  12727. 1.8678 -1.4641 0.0166 H 0 0 0 0 0 0 0 0 0 0 0 0
  12728. 1 2 2 0
  12729. 2 3 1 0
  12730. 3 4 2 0
  12731. 4 5 1 0
  12732. 5 6 2 0
  12733. 6 1 1 0
  12734. 1 7 1 0
  12735. 2 8 1 0
  12736. 3 9 1 0
  12737. 5 10 1 0
  12738. 6 11 1 0
  12739. M END
  12740. $$$$
  12741. RDKit 3D
  12742. 11 11 0 0 0 0 0 0 0 0999 V2000
  12743. -0.2702 -1.1525 0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0
  12744. -1.2785 -0.1944 0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0
  12745. -0.9129 1.1421 -0.0103 C 0 0 0 0 0 0 0 0 0 0 0 0
  12746. 0.3682 1.5705 -0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0
  12747. 1.3253 0.6172 -0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0
  12748. 1.0589 -0.7425 0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
  12749. -0.5180 -2.2098 0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0
  12750. -2.3238 -0.4812 0.0268 H 0 0 0 0 0 0 0 0 0 0 0 0
  12751. -1.6631 1.9275 -0.0163 H 0 0 0 0 0 0 0 0 0 0 0 0
  12752. 2.3464 0.9872 -0.0348 H 0 0 0 0 0 0 0 0 0 0 0 0
  12753. 1.8678 -1.4641 0.0074 H 0 0 0 0 0 0 0 0 0 0 0 0
  12754. 1 2 2 0
  12755. 2 3 1 0
  12756. 3 4 2 0
  12757. 4 5 1 0
  12758. 5 6 2 0
  12759. 6 1 1 0
  12760. 1 7 1 0
  12761. 2 8 1 0
  12762. 3 9 1 0
  12763. 5 10 1 0
  12764. 6 11 1 0
  12765. M END
  12766. $$$$
  12767. RDKit 3D
  12768. 11 11 0 0 0 0 0 0 0 0999 V2000
  12769. -0.2702 -1.1526 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0
  12770. -1.2785 -0.1945 0.0124 C 0 0 0 0 0 0 0 0 0 0 0 0
  12771. -0.9129 1.1421 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0
  12772. 0.3682 1.5706 -0.0177 N 0 0 0 0 0 0 0 0 0 0 0 0
  12773. 1.3253 0.6173 -0.0167 C 0 0 0 0 0 0 0 0 0 0 0 0
  12774. 1.0589 -0.7425 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0
  12775. -0.5180 -2.2100 0.0249 H 0 0 0 0 0 0 0 0 0 0 0 0
  12776. -2.3238 -0.4813 0.0237 H 0 0 0 0 0 0 0 0 0 0 0 0
  12777. -1.6631 1.9275 -0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0
  12778. 2.3464 0.9874 -0.0286 H 0 0 0 0 0 0 0 0 0 0 0 0
  12779. 1.8678 -1.4642 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0
  12780. 1 2 2 0
  12781. 2 3 1 0
  12782. 3 4 2 0
  12783. 4 5 1 0
  12784. 5 6 2 0
  12785. 6 1 1 0
  12786. 1 7 1 0
  12787. 2 8 1 0
  12788. 3 9 1 0
  12789. 5 10 1 0
  12790. 6 11 1 0
  12791. M END
  12792. $$$$
  12793. RDKit 3D
  12794. 11 11 0 0 0 0 0 0 0 0999 V2000
  12795. -0.2702 -1.1526 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0
  12796. -1.2785 -0.1945 0.0112 C 0 0 0 0 0 0 0 0 0 0 0 0
  12797. -0.9129 1.1421 0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0
  12798. 0.3682 1.5707 -0.0078 N 0 0 0 0 0 0 0 0 0 0 0 0
  12799. 1.3253 0.6174 -0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0
  12800. 1.0589 -0.7425 -0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
  12801. -0.5180 -2.2101 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  12802. -2.3238 -0.4815 0.0207 H 0 0 0 0 0 0 0 0 0 0 0 0
  12803. -1.6631 1.9275 0.0079 H 0 0 0 0 0 0 0 0 0 0 0 0
  12804. 2.3464 0.9875 -0.0224 H 0 0 0 0 0 0 0 0 0 0 0 0
  12805. 1.8678 -1.4641 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  12806. 1 2 2 0
  12807. 2 3 1 0
  12808. 3 4 2 0
  12809. 4 5 1 0
  12810. 5 6 2 0
  12811. 6 1 1 0
  12812. 1 7 1 0
  12813. 2 8 1 0
  12814. 3 9 1 0
  12815. 5 10 1 0
  12816. 6 11 1 0
  12817. M END
  12818. $$$$
  12819. RDKit 3D
  12820. 11 11 0 0 0 0 0 0 0 0999 V2000
  12821. -0.2702 -1.1526 -0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0
  12822. -1.2785 -0.1946 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0
  12823. -0.9129 1.1421 0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0
  12824. 0.3682 1.5707 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0
  12825. 1.3253 0.6175 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  12826. 1.0589 -0.7425 -0.0112 C 0 0 0 0 0 0 0 0 0 0 0 0
  12827. -0.5180 -2.2101 -0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0
  12828. -2.3238 -0.4816 0.0177 H 0 0 0 0 0 0 0 0 0 0 0 0
  12829. -1.6631 1.9274 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0
  12830. 2.3464 0.9877 -0.0162 H 0 0 0 0 0 0 0 0 0 0 0 0
  12831. 1.8678 -1.4640 -0.0202 H 0 0 0 0 0 0 0 0 0 0 0 0
  12832. 1 2 2 0
  12833. 2 3 1 0
  12834. 3 4 2 0
  12835. 4 5 1 0
  12836. 5 6 2 0
  12837. 6 1 1 0
  12838. 1 7 1 0
  12839. 2 8 1 0
  12840. 3 9 1 0
  12841. 5 10 1 0
  12842. 6 11 1 0
  12843. M END
  12844. $$$$
  12845. RDKit 3D
  12846. 11 11 0 0 0 0 0 0 0 0999 V2000
  12847. -0.2702 -1.1526 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
  12848. -1.2785 -0.1947 0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
  12849. -0.9129 1.1420 0.0184 C 0 0 0 0 0 0 0 0 0 0 0 0
  12850. 0.3682 1.5707 0.0119 N 0 0 0 0 0 0 0 0 0 0 0 0
  12851. 1.3253 0.6175 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0
  12852. 1.0589 -0.7424 -0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
  12853. -0.5180 -2.2100 -0.0167 H 0 0 0 0 0 0 0 0 0 0 0 0
  12854. -2.3238 -0.4817 0.0147 H 0 0 0 0 0 0 0 0 0 0 0 0
  12855. -1.6631 1.9273 0.0321 H 0 0 0 0 0 0 0 0 0 0 0 0
  12856. 2.3464 0.9877 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  12857. 1.8678 -1.4639 -0.0294 H 0 0 0 0 0 0 0 0 0 0 0 0
  12858. 1 2 2 0
  12859. 2 3 1 0
  12860. 3 4 2 0
  12861. 4 5 1 0
  12862. 5 6 2 0
  12863. 6 1 1 0
  12864. 1 7 1 0
  12865. 2 8 1 0
  12866. 3 9 1 0
  12867. 5 10 1 0
  12868. 6 11 1 0
  12869. M END
  12870. $$$$
  12871. RDKit 3D
  12872. 11 11 0 0 0 0 0 0 0 0999 V2000
  12873. -0.2702 -1.1525 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0
  12874. -1.2785 -0.1947 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0
  12875. -0.9129 1.1419 0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0
  12876. 0.3682 1.5706 0.0218 N 0 0 0 0 0 0 0 0 0 0 0 0
  12877. 1.3253 0.6176 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
  12878. 1.0589 -0.7423 -0.0205 C 0 0 0 0 0 0 0 0 0 0 0 0
  12879. -0.5180 -2.2099 -0.0306 H 0 0 0 0 0 0 0 0 0 0 0 0
  12880. -2.3238 -0.4818 0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0
  12881. -1.6631 1.9270 0.0442 H 0 0 0 0 0 0 0 0 0 0 0 0
  12882. 2.3464 0.9878 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
  12883. 1.8678 -1.4637 -0.0386 H 0 0 0 0 0 0 0 0 0 0 0 0
  12884. 1 2 2 0
  12885. 2 3 1 0
  12886. 3 4 2 0
  12887. 4 5 1 0
  12888. 5 6 2 0
  12889. 6 1 1 0
  12890. 1 7 1 0
  12891. 2 8 1 0
  12892. 3 9 1 0
  12893. 5 10 1 0
  12894. 6 11 1 0
  12895. M END
  12896. $$$$
  12897. RDKit 3D
  12898. 11 11 0 0 0 0 0 0 0 0999 V2000
  12899. -0.2702 -1.1524 -0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0
  12900. -1.2785 -0.1948 0.0063 C 0 0 0 0 0 0 0 0 0 0 0 0
  12901. -0.9129 1.1417 0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0
  12902. 0.3682 1.5704 0.0316 N 0 0 0 0 0 0 0 0 0 0 0 0
  12903. 1.3253 0.6176 0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0
  12904. 1.0589 -0.7421 -0.0252 C 0 0 0 0 0 0 0 0 0 0 0 0
  12905. -0.5180 -2.2097 -0.0445 H 0 0 0 0 0 0 0 0 0 0 0 0
  12906. -2.3238 -0.4818 0.0086 H 0 0 0 0 0 0 0 0 0 0 0 0
  12907. -1.6631 1.9267 0.0563 H 0 0 0 0 0 0 0 0 0 0 0 0
  12908. 2.3464 0.9878 0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0
  12909. 1.8678 -1.4634 -0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0
  12910. 1 2 2 0
  12911. 2 3 1 0
  12912. 3 4 2 0
  12913. 4 5 1 0
  12914. 5 6 2 0
  12915. 6 1 1 0
  12916. 1 7 1 0
  12917. 2 8 1 0
  12918. 3 9 1 0
  12919. 5 10 1 0
  12920. 6 11 1 0
  12921. M END
  12922. $$$$
  12923. RDKit 3D
  12924. 11 11 0 0 0 0 0 0 0 0999 V2000
  12925. -0.2702 -1.1522 -0.0305 C 0 0 0 0 0 0 0 0 0 0 0 0
  12926. -1.2785 -0.1948 0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0
  12927. -0.9129 1.1415 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  12928. 0.3682 1.5702 0.0415 N 0 0 0 0 0 0 0 0 0 0 0 0
  12929. 1.3253 0.6175 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
  12930. 1.0589 -0.7419 -0.0298 C 0 0 0 0 0 0 0 0 0 0 0 0
  12931. -0.5180 -2.2093 -0.0584 H 0 0 0 0 0 0 0 0 0 0 0 0
  12932. -2.3238 -0.4819 0.0056 H 0 0 0 0 0 0 0 0 0 0 0 0
  12933. -1.6631 1.9263 0.0684 H 0 0 0 0 0 0 0 0 0 0 0 0
  12934. 2.3464 0.9877 0.0086 H 0 0 0 0 0 0 0 0 0 0 0 0
  12935. 1.8678 -1.4631 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0
  12936. 1 2 2 0
  12937. 2 3 1 0
  12938. 3 4 2 0
  12939. 4 5 1 0
  12940. 5 6 2 0
  12941. 6 1 1 0
  12942. 1 7 1 0
  12943. 2 8 1 0
  12944. 3 9 1 0
  12945. 5 10 1 0
  12946. 6 11 1 0
  12947. M END
  12948. $$$$
  12949. RDKit 3D
  12950. 11 11 0 0 0 0 0 0 0 0999 V2000
  12951. -0.2702 -1.1520 -0.0377 C 0 0 0 0 0 0 0 0 0 0 0 0
  12952. -1.2785 -0.1948 0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
  12953. -0.9129 1.1412 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
  12954. 0.3682 1.5699 0.0514 N 0 0 0 0 0 0 0 0 0 0 0 0
  12955. 1.3253 0.6175 0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0
  12956. 1.0589 -0.7417 -0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0
  12957. -0.5180 -2.2089 -0.0723 H 0 0 0 0 0 0 0 0 0 0 0 0
  12958. -2.3238 -0.4819 0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
  12959. -1.6631 1.9259 0.0805 H 0 0 0 0 0 0 0 0 0 0 0 0
  12960. 2.3464 0.9877 0.0148 H 0 0 0 0 0 0 0 0 0 0 0 0
  12961. 1.8678 -1.4627 -0.0662 H 0 0 0 0 0 0 0 0 0 0 0 0
  12962. 1 2 2 0
  12963. 2 3 1 0
  12964. 3 4 2 0
  12965. 4 5 1 0
  12966. 5 6 2 0
  12967. 6 1 1 0
  12968. 1 7 1 0
  12969. 2 8 1 0
  12970. 3 9 1 0
  12971. 5 10 1 0
  12972. 6 11 1 0
  12973. M END
  12974. $$$$
  12975. RDKit 3D
  12976. 11 11 0 0 0 0 0 0 0 0999 V2000
  12977. -0.2702 -1.1518 -0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0
  12978. -1.2785 -0.1948 0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0
  12979. -0.9129 1.1409 0.0543 C 0 0 0 0 0 0 0 0 0 0 0 0
  12980. 0.3682 1.5695 0.0612 N 0 0 0 0 0 0 0 0 0 0 0 0
  12981. 1.3253 0.6174 0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0
  12982. 1.0589 -0.7415 -0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0
  12983. -0.5180 -2.2084 -0.0862 H 0 0 0 0 0 0 0 0 0 0 0 0
  12984. -2.3238 -0.4819 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
  12985. -1.6631 1.9253 0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0
  12986. 2.3464 0.9876 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
  12987. 1.8678 -1.4622 -0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0
  12988. 1 2 2 0
  12989. 2 3 1 0
  12990. 3 4 2 0
  12991. 4 5 1 0
  12992. 5 6 2 0
  12993. 6 1 1 0
  12994. 1 7 1 0
  12995. 2 8 1 0
  12996. 3 9 1 0
  12997. 5 10 1 0
  12998. 6 11 1 0
  12999. M END
  13000. $$$$
  13001. RDKit 3D
  13002. 11 11 0 0 0 0 0 0 0 0999 V2000
  13003. -0.2702 -1.1515 -0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0
  13004. -1.2785 -0.1948 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
  13005. -0.9129 1.1405 0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0
  13006. 0.3682 1.5691 0.0711 N 0 0 0 0 0 0 0 0 0 0 0 0
  13007. 1.3253 0.6173 0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0
  13008. 1.0589 -0.7412 -0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0
  13009. -0.5180 -2.2078 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
  13010. -2.3238 -0.4819 -0.0035 H 0 0 0 0 0 0 0 0 0 0 0 0
  13011. -1.6631 1.9247 0.1047 H 0 0 0 0 0 0 0 0 0 0 0 0
  13012. 2.3464 0.9874 0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0
  13013. 1.8678 -1.4617 -0.0846 H 0 0 0 0 0 0 0 0 0 0 0 0
  13014. 1 2 2 0
  13015. 2 3 1 0
  13016. 3 4 2 0
  13017. 4 5 1 0
  13018. 5 6 2 0
  13019. 6 1 1 0
  13020. 1 7 1 0
  13021. 2 8 1 0
  13022. 3 9 1 0
  13023. 5 10 1 0
  13024. 6 11 1 0
  13025. M END
  13026. $$$$
  13027. RDKit 3D
  13028. 11 11 0 0 0 0 0 0 0 0999 V2000
  13029. -0.2702 -1.1511 -0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0
  13030. -1.2785 -0.1949 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
  13031. -0.9129 1.1401 0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0
  13032. 0.3682 1.5686 0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0
  13033. 1.3253 0.6172 0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0
  13034. 1.0589 -0.7410 -0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0
  13035. -0.5180 -2.2072 -0.1139 H 0 0 0 0 0 0 0 0 0 0 0 0
  13036. -2.3238 -0.4819 -0.0065 H 0 0 0 0 0 0 0 0 0 0 0 0
  13037. -1.6631 1.9240 0.1168 H 0 0 0 0 0 0 0 0 0 0 0 0
  13038. 2.3464 0.9872 0.0334 H 0 0 0 0 0 0 0 0 0 0 0 0
  13039. 1.8678 -1.4612 -0.0937 H 0 0 0 0 0 0 0 0 0 0 0 0
  13040. 1 2 2 0
  13041. 2 3 1 0
  13042. 3 4 2 0
  13043. 4 5 1 0
  13044. 5 6 2 0
  13045. 6 1 1 0
  13046. 1 7 1 0
  13047. 2 8 1 0
  13048. 3 9 1 0
  13049. 5 10 1 0
  13050. 6 11 1 0
  13051. M END
  13052. $$$$
  13053. RDKit 3D
  13054. 11 11 0 0 0 0 0 0 0 0999 V2000
  13055. -0.2702 -1.1507 -0.0666 C 0 0 0 0 0 0 0 0 0 0 0 0
  13056. -1.2785 -0.1949 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0
  13057. -0.9129 1.1396 0.0758 C 0 0 0 0 0 0 0 0 0 0 0 0
  13058. 0.3682 1.5681 0.0908 N 0 0 0 0 0 0 0 0 0 0 0 0
  13059. 1.3253 0.6170 0.0259 C 0 0 0 0 0 0 0 0 0 0 0 0
  13060. 1.0589 -0.7406 -0.0531 C 0 0 0 0 0 0 0 0 0 0 0 0
  13061. -0.5180 -2.2064 -0.1278 H 0 0 0 0 0 0 0 0 0 0 0 0
  13062. -2.3238 -0.4818 -0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0
  13063. -1.6631 1.9232 0.1289 H 0 0 0 0 0 0 0 0 0 0 0 0
  13064. 2.3464 0.9870 0.0396 H 0 0 0 0 0 0 0 0 0 0 0 0
  13065. 1.8678 -1.4605 -0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0
  13066. 1 2 2 0
  13067. 2 3 1 0
  13068. 3 4 2 0
  13069. 4 5 1 0
  13070. 5 6 2 0
  13071. 6 1 1 0
  13072. 1 7 1 0
  13073. 2 8 1 0
  13074. 3 9 1 0
  13075. 5 10 1 0
  13076. 6 11 1 0
  13077. M END
  13078. $$$$
  13079. RDKit 3D
  13080. 11 11 0 0 0 0 0 0 0 0999 V2000
  13081. -0.2702 -1.1503 -0.0739 C 0 0 0 0 0 0 0 0 0 0 0 0
  13082. -1.2785 -0.1948 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
  13083. -0.9129 1.1391 0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0
  13084. 0.3682 1.5675 0.1007 N 0 0 0 0 0 0 0 0 0 0 0 0
  13085. 1.3253 0.6168 0.0298 C 0 0 0 0 0 0 0 0 0 0 0 0
  13086. 1.0589 -0.7403 -0.0578 C 0 0 0 0 0 0 0 0 0 0 0 0
  13087. -0.5180 -2.2056 -0.1416 H 0 0 0 0 0 0 0 0 0 0 0 0
  13088. -2.3238 -0.4817 -0.0126 H 0 0 0 0 0 0 0 0 0 0 0 0
  13089. -1.6631 1.9224 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  13090. 2.3464 0.9867 0.0458 H 0 0 0 0 0 0 0 0 0 0 0 0
  13091. 1.8678 -1.4599 -0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0
  13092. 1 2 2 0
  13093. 2 3 1 0
  13094. 3 4 2 0
  13095. 4 5 1 0
  13096. 5 6 2 0
  13097. 6 1 1 0
  13098. 1 7 1 0
  13099. 2 8 1 0
  13100. 3 9 1 0
  13101. 5 10 1 0
  13102. 6 11 1 0
  13103. M END
  13104. $$$$
  13105. RDKit 3D
  13106. 11 11 0 0 0 0 0 0 0 0999 V2000
  13107. -0.2702 -1.1498 -0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0
  13108. -1.2785 -0.1948 -0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0
  13109. -0.9129 1.1386 0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
  13110. 0.3682 1.5668 0.1105 N 0 0 0 0 0 0 0 0 0 0 0 0
  13111. 1.3253 0.6166 0.0337 C 0 0 0 0 0 0 0 0 0 0 0 0
  13112. 1.0589 -0.7399 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0
  13113. -0.5180 -2.2046 -0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0
  13114. -2.3238 -0.4816 -0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0
  13115. -1.6631 1.9214 0.1531 H 0 0 0 0 0 0 0 0 0 0 0 0
  13116. 2.3464 0.9864 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0
  13117. 1.8678 -1.4591 -0.1213 H 0 0 0 0 0 0 0 0 0 0 0 0
  13118. 1 2 2 0
  13119. 2 3 1 0
  13120. 3 4 2 0
  13121. 4 5 1 0
  13122. 5 6 2 0
  13123. 6 1 1 0
  13124. 1 7 1 0
  13125. 2 8 1 0
  13126. 3 9 1 0
  13127. 5 10 1 0
  13128. 6 11 1 0
  13129. M END
  13130. $$$$
  13131. RDKit 3D
  13132. 11 11 0 0 0 0 0 0 0 0999 V2000
  13133. -0.2702 -1.1493 -0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0
  13134. -1.2785 -0.1948 -0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0
  13135. -0.9129 1.1380 0.0973 C 0 0 0 0 0 0 0 0 0 0 0 0
  13136. 0.3682 1.5661 0.1203 N 0 0 0 0 0 0 0 0 0 0 0 0
  13137. 1.3253 0.6164 0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
  13138. 1.0589 -0.7395 -0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0
  13139. -0.5180 -2.2036 -0.1693 H 0 0 0 0 0 0 0 0 0 0 0 0
  13140. -2.3238 -0.4815 -0.0186 H 0 0 0 0 0 0 0 0 0 0 0 0
  13141. -1.6631 1.9205 0.1651 H 0 0 0 0 0 0 0 0 0 0 0 0
  13142. 2.3464 0.9861 0.0582 H 0 0 0 0 0 0 0 0 0 0 0 0
  13143. 1.8678 -1.4583 -0.1304 H 0 0 0 0 0 0 0 0 0 0 0 0
  13144. 1 2 2 0
  13145. 2 3 1 0
  13146. 3 4 2 0
  13147. 4 5 1 0
  13148. 5 6 2 0
  13149. 6 1 1 0
  13150. 1 7 1 0
  13151. 2 8 1 0
  13152. 3 9 1 0
  13153. 5 10 1 0
  13154. 6 11 1 0
  13155. M END
  13156. $$$$
  13157. RDKit 3D
  13158. 11 11 0 0 0 0 0 0 0 0999 V2000
  13159. -0.2702 -1.1487 -0.0955 C 0 0 0 0 0 0 0 0 0 0 0 0
  13160. -1.2785 -0.1948 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  13161. -0.9129 1.1374 0.1044 C 0 0 0 0 0 0 0 0 0 0 0 0
  13162. 0.3682 1.5653 0.1302 N 0 0 0 0 0 0 0 0 0 0 0 0
  13163. 1.3253 0.6162 0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0
  13164. 1.0589 -0.7391 -0.0717 C 0 0 0 0 0 0 0 0 0 0 0 0
  13165. -0.5180 -2.2025 -0.1832 H 0 0 0 0 0 0 0 0 0 0 0 0
  13166. -2.3238 -0.4814 -0.0217 H 0 0 0 0 0 0 0 0 0 0 0 0
  13167. -1.6631 1.9194 0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0
  13168. 2.3464 0.9857 0.0644 H 0 0 0 0 0 0 0 0 0 0 0 0
  13169. 1.8678 -1.4575 -0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0
  13170. 1 2 2 0
  13171. 2 3 1 0
  13172. 3 4 2 0
  13173. 4 5 1 0
  13174. 5 6 2 0
  13175. 6 1 1 0
  13176. 1 7 1 0
  13177. 2 8 1 0
  13178. 3 9 1 0
  13179. 5 10 1 0
  13180. 6 11 1 0
  13181. M END
  13182. $$$$
  13183. RDKit 3D
  13184. 11 11 0 0 0 0 0 0 0 0999 V2000
  13185. -0.2702 -1.1481 -0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0
  13186. -1.2785 -0.1947 -0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0
  13187. -0.9129 1.1367 0.1115 C 0 0 0 0 0 0 0 0 0 0 0 0
  13188. 0.3682 1.5645 0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0
  13189. 1.3253 0.6159 0.0453 C 0 0 0 0 0 0 0 0 0 0 0 0
  13190. 1.0589 -0.7386 -0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0
  13191. -0.5180 -2.2013 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0
  13192. -2.3238 -0.4813 -0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0
  13193. -1.6631 1.9182 0.1893 H 0 0 0 0 0 0 0 0 0 0 0 0
  13194. 2.3464 0.9853 0.0706 H 0 0 0 0 0 0 0 0 0 0 0 0
  13195. 1.8678 -1.4566 -0.1487 H 0 0 0 0 0 0 0 0 0 0 0 0
  13196. 1 2 2 0
  13197. 2 3 1 0
  13198. 3 4 2 0
  13199. 4 5 1 0
  13200. 5 6 2 0
  13201. 6 1 1 0
  13202. 1 7 1 0
  13203. 2 8 1 0
  13204. 3 9 1 0
  13205. 5 10 1 0
  13206. 6 11 1 0
  13207. M END
  13208. $$$$
  13209. RDKit 3D
  13210. 11 11 0 0 0 0 0 0 0 0999 V2000
  13211. -0.2702 -1.1474 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0
  13212. -1.2785 -0.1947 -0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
  13213. -0.9129 1.1360 0.1187 C 0 0 0 0 0 0 0 0 0 0 0 0
  13214. 0.3682 1.5636 0.1498 N 0 0 0 0 0 0 0 0 0 0 0 0
  13215. 1.3253 0.6156 0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0
  13216. 1.0589 -0.7381 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0
  13217. -0.5180 -2.2000 -0.2108 H 0 0 0 0 0 0 0 0 0 0 0 0
  13218. -2.3238 -0.4811 -0.0277 H 0 0 0 0 0 0 0 0 0 0 0 0
  13219. -1.6631 1.9170 0.2013 H 0 0 0 0 0 0 0 0 0 0 0 0
  13220. 2.3464 0.9848 0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0
  13221. 1.8678 -1.4556 -0.1579 H 0 0 0 0 0 0 0 0 0 0 0 0
  13222. 1 2 2 0
  13223. 2 3 1 0
  13224. 3 4 2 0
  13225. 4 5 1 0
  13226. 5 6 2 0
  13227. 6 1 1 0
  13228. 1 7 1 0
  13229. 2 8 1 0
  13230. 3 9 1 0
  13231. 5 10 1 0
  13232. 6 11 1 0
  13233. M END
  13234. $$$$
  13235. RDKit 3D
  13236. 11 11 0 0 0 0 0 0 0 0999 V2000
  13237. -0.2702 -1.1467 -0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0
  13238. -1.2785 -0.1946 -0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0
  13239. -0.9129 1.1352 0.1258 C 0 0 0 0 0 0 0 0 0 0 0 0
  13240. 0.3682 1.5626 0.1597 N 0 0 0 0 0 0 0 0 0 0 0 0
  13241. 1.3253 0.6153 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  13242. 1.0589 -0.7376 -0.0856 C 0 0 0 0 0 0 0 0 0 0 0 0
  13243. -0.5180 -2.1987 -0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0
  13244. -2.3238 -0.4809 -0.0307 H 0 0 0 0 0 0 0 0 0 0 0 0
  13245. -1.6631 1.9157 0.2134 H 0 0 0 0 0 0 0 0 0 0 0 0
  13246. 2.3464 0.9843 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0
  13247. 1.8678 -1.4546 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  13248. 1 2 2 0
  13249. 2 3 1 0
  13250. 3 4 2 0
  13251. 4 5 1 0
  13252. 5 6 2 0
  13253. 6 1 1 0
  13254. 1 7 1 0
  13255. 2 8 1 0
  13256. 3 9 1 0
  13257. 5 10 1 0
  13258. 6 11 1 0
  13259. M END
  13260. $$$$
  13261. RDKit 3D
  13262. 11 11 0 0 0 0 0 0 0 0999 V2000
  13263. -0.2702 -1.1459 -0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0
  13264. -1.2785 -0.1946 -0.0108 C 0 0 0 0 0 0 0 0 0 0 0 0
  13265. -0.9129 1.1344 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0
  13266. 0.3682 1.5616 0.1695 N 0 0 0 0 0 0 0 0 0 0 0 0
  13267. 1.3253 0.6149 0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0
  13268. 1.0589 -0.7370 -0.0903 C 0 0 0 0 0 0 0 0 0 0 0 0
  13269. -0.5180 -2.1972 -0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0
  13270. -2.3238 -0.4807 -0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0
  13271. -1.6631 1.9143 0.2254 H 0 0 0 0 0 0 0 0 0 0 0 0
  13272. 2.3464 0.9838 0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0
  13273. 1.8678 -1.4535 -0.1762 H 0 0 0 0 0 0 0 0 0 0 0 0
  13274. 1 2 2 0
  13275. 2 3 1 0
  13276. 3 4 2 0
  13277. 4 5 1 0
  13278. 5 6 2 0
  13279. 6 1 1 0
  13280. 1 7 1 0
  13281. 2 8 1 0
  13282. 3 9 1 0
  13283. 5 10 1 0
  13284. 6 11 1 0
  13285. M END
  13286. $$$$
  13287. RDKit 3D
  13288. 11 11 0 0 0 0 0 0 0 0999 V2000
  13289. -0.2702 -1.1451 -0.1316 C 0 0 0 0 0 0 0 0 0 0 0 0
  13290. -1.2785 -0.1945 -0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0
  13291. -0.9129 1.1335 0.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
  13292. 0.3682 1.5605 0.1793 N 0 0 0 0 0 0 0 0 0 0 0 0
  13293. 1.3253 0.6146 0.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
  13294. 1.0589 -0.7365 -0.0949 C 0 0 0 0 0 0 0 0 0 0 0 0
  13295. -0.5180 -2.1957 -0.2523 H 0 0 0 0 0 0 0 0 0 0 0 0
  13296. -2.3238 -0.4805 -0.0368 H 0 0 0 0 0 0 0 0 0 0 0 0
  13297. -1.6631 1.9129 0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0
  13298. 2.3464 0.9832 0.0953 H 0 0 0 0 0 0 0 0 0 0 0 0
  13299. 1.8678 -1.4524 -0.1853 H 0 0 0 0 0 0 0 0 0 0 0 0
  13300. 1 2 2 0
  13301. 2 3 1 0
  13302. 3 4 2 0
  13303. 4 5 1 0
  13304. 5 6 2 0
  13305. 6 1 1 0
  13306. 1 7 1 0
  13307. 2 8 1 0
  13308. 3 9 1 0
  13309. 5 10 1 0
  13310. 6 11 1 0
  13311. M END
  13312. $$$$
  13313. RDKit 3D
  13314. 11 11 0 0 0 0 0 0 0 0999 V2000
  13315. -0.2702 -1.1443 -0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0
  13316. -1.2785 -0.1944 -0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0
  13317. -0.9129 1.1326 0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0
  13318. 0.3682 1.5593 0.1891 N 0 0 0 0 0 0 0 0 0 0 0 0
  13319. 1.3253 0.6142 0.0646 C 0 0 0 0 0 0 0 0 0 0 0 0
  13320. 1.0589 -0.7358 -0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0
  13321. -0.5180 -2.1940 -0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0
  13322. -2.3238 -0.4803 -0.0398 H 0 0 0 0 0 0 0 0 0 0 0 0
  13323. -1.6631 1.9113 0.2494 H 0 0 0 0 0 0 0 0 0 0 0 0
  13324. 2.3464 0.9826 0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0
  13325. 1.8678 -1.4512 -0.1944 H 0 0 0 0 0 0 0 0 0 0 0 0
  13326. 1 2 2 0
  13327. 2 3 1 0
  13328. 3 4 2 0
  13329. 4 5 1 0
  13330. 5 6 2 0
  13331. 6 1 1 0
  13332. 1 7 1 0
  13333. 2 8 1 0
  13334. 3 9 1 0
  13335. 5 10 1 0
  13336. 6 11 1 0
  13337. M END
  13338. $$$$
  13339. RDKit 3D
  13340. 11 11 0 0 0 0 0 0 0 0999 V2000
  13341. -0.2702 -1.1434 -0.1459 C 0 0 0 0 0 0 0 0 0 0 0 0
  13342. -1.2785 -0.1943 -0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0
  13343. -0.9129 1.1317 0.1543 C 0 0 0 0 0 0 0 0 0 0 0 0
  13344. 0.3682 1.5581 0.1989 N 0 0 0 0 0 0 0 0 0 0 0 0
  13345. 1.3253 0.6138 0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0
  13346. 1.0589 -0.7352 -0.1041 C 0 0 0 0 0 0 0 0 0 0 0 0
  13347. -0.5180 -2.1923 -0.2798 H 0 0 0 0 0 0 0 0 0 0 0 0
  13348. -2.3238 -0.4800 -0.0428 H 0 0 0 0 0 0 0 0 0 0 0 0
  13349. -1.6631 1.9097 0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0
  13350. 2.3464 0.9819 0.1077 H 0 0 0 0 0 0 0 0 0 0 0 0
  13351. 1.8678 -1.4500 -0.2035 H 0 0 0 0 0 0 0 0 0 0 0 0
  13352. 1 2 2 0
  13353. 2 3 1 0
  13354. 3 4 2 0
  13355. 4 5 1 0
  13356. 5 6 2 0
  13357. 6 1 1 0
  13358. 1 7 1 0
  13359. 2 8 1 0
  13360. 3 9 1 0
  13361. 5 10 1 0
  13362. 6 11 1 0
  13363. M END
  13364. $$$$
  13365. RDKit 3D
  13366. 11 11 0 0 0 0 0 0 0 0999 V2000
  13367. -0.2702 -1.1424 -0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0
  13368. -1.2785 -0.1942 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0
  13369. -0.9129 1.1307 0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0
  13370. 0.3682 1.5568 0.2087 N 0 0 0 0 0 0 0 0 0 0 0 0
  13371. 1.3253 0.6133 0.0723 C 0 0 0 0 0 0 0 0 0 0 0 0
  13372. 1.0589 -0.7345 -0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0
  13373. -0.5180 -2.1905 -0.2936 H 0 0 0 0 0 0 0 0 0 0 0 0
  13374. -2.3238 -0.4797 -0.0458 H 0 0 0 0 0 0 0 0 0 0 0 0
  13375. -1.6631 1.9080 0.2734 H 0 0 0 0 0 0 0 0 0 0 0 0
  13376. 2.3464 0.9812 0.1138 H 0 0 0 0 0 0 0 0 0 0 0 0
  13377. 1.8678 -1.4486 -0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0
  13378. 1 2 2 0
  13379. 2 3 1 0
  13380. 3 4 2 0
  13381. 4 5 1 0
  13382. 5 6 2 0
  13383. 6 1 1 0
  13384. 1 7 1 0
  13385. 2 8 1 0
  13386. 3 9 1 0
  13387. 5 10 1 0
  13388. 6 11 1 0
  13389. M END
  13390. $$$$
  13391. RDKit 3D
  13392. 11 11 0 0 0 0 0 0 0 0999 V2000
  13393. -0.2702 -1.1414 -0.1603 C 0 0 0 0 0 0 0 0 0 0 0 0
  13394. -1.2785 -0.1941 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
  13395. -0.9129 1.1297 0.1685 C 0 0 0 0 0 0 0 0 0 0 0 0
  13396. 0.3682 1.5555 0.2184 N 0 0 0 0 0 0 0 0 0 0 0 0
  13397. 1.3253 0.6128 0.0762 C 0 0 0 0 0 0 0 0 0 0 0 0
  13398. 1.0589 -0.7338 -0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0
  13399. -0.5180 -2.1886 -0.3074 H 0 0 0 0 0 0 0 0 0 0 0 0
  13400. -2.3238 -0.4794 -0.0488 H 0 0 0 0 0 0 0 0 0 0 0 0
  13401. -1.6631 1.9063 0.2854 H 0 0 0 0 0 0 0 0 0 0 0 0
  13402. 2.3464 0.9805 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0
  13403. 1.8678 -1.4473 -0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0
  13404. 1 2 2 0
  13405. 2 3 1 0
  13406. 3 4 2 0
  13407. 4 5 1 0
  13408. 5 6 2 0
  13409. 6 1 1 0
  13410. 1 7 1 0
  13411. 2 8 1 0
  13412. 3 9 1 0
  13413. 5 10 1 0
  13414. 6 11 1 0
  13415. M END
  13416. $$$$
  13417. RDKit 3D
  13418. 11 11 0 0 0 0 0 0 0 0999 V2000
  13419. -0.2702 -1.1404 -0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0
  13420. -1.2785 -0.1940 -0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0
  13421. -0.9129 1.1286 0.1756 C 0 0 0 0 0 0 0 0 0 0 0 0
  13422. 0.3682 1.5541 0.2282 N 0 0 0 0 0 0 0 0 0 0 0 0
  13423. 1.3253 0.6124 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  13424. 1.0589 -0.7331 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0
  13425. -0.5180 -2.1867 -0.3211 H 0 0 0 0 0 0 0 0 0 0 0 0
  13426. -2.3238 -0.4791 -0.0519 H 0 0 0 0 0 0 0 0 0 0 0 0
  13427. -1.6631 1.9045 0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0
  13428. 2.3464 0.9797 0.1262 H 0 0 0 0 0 0 0 0 0 0 0 0
  13429. 1.8678 -1.4459 -0.2308 H 0 0 0 0 0 0 0 0 0 0 0 0
  13430. 1 2 2 0
  13431. 2 3 1 0
  13432. 3 4 2 0
  13433. 4 5 1 0
  13434. 5 6 2 0
  13435. 6 1 1 0
  13436. 1 7 1 0
  13437. 2 8 1 0
  13438. 3 9 1 0
  13439. 5 10 1 0
  13440. 6 11 1 0
  13441. M END
  13442. $$$$
  13443. RDKit 3D
  13444. 11 11 0 0 0 0 0 0 0 0999 V2000
  13445. -0.2702 -1.1393 -0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
  13446. -1.2785 -0.1939 -0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0
  13447. -0.9129 1.1274 0.1827 C 0 0 0 0 0 0 0 0 0 0 0 0
  13448. 0.3682 1.5526 0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0
  13449. 1.3253 0.6118 0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0
  13450. 1.0589 -0.7324 -0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0
  13451. -0.5180 -2.1846 -0.3348 H 0 0 0 0 0 0 0 0 0 0 0 0
  13452. -2.3238 -0.4788 -0.0549 H 0 0 0 0 0 0 0 0 0 0 0 0
  13453. -1.6631 1.9026 0.3093 H 0 0 0 0 0 0 0 0 0 0 0 0
  13454. 2.3464 0.9789 0.1323 H 0 0 0 0 0 0 0 0 0 0 0 0
  13455. 1.8678 -1.4444 -0.2399 H 0 0 0 0 0 0 0 0 0 0 0 0
  13456. 1 2 2 0
  13457. 2 3 1 0
  13458. 3 4 2 0
  13459. 4 5 1 0
  13460. 5 6 2 0
  13461. 6 1 1 0
  13462. 1 7 1 0
  13463. 2 8 1 0
  13464. 3 9 1 0
  13465. 5 10 1 0
  13466. 6 11 1 0
  13467. M END
  13468. $$$$
  13469. RDKit 3D
  13470. 11 11 0 0 0 0 0 0 0 0999 V2000
  13471. -0.2702 -1.1382 -0.1818 C 0 0 0 0 0 0 0 0 0 0 0 0
  13472. -1.2785 -0.1938 -0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0
  13473. -0.9129 1.1263 0.1898 C 0 0 0 0 0 0 0 0 0 0 0 0
  13474. 0.3682 1.5511 0.2477 N 0 0 0 0 0 0 0 0 0 0 0 0
  13475. 1.3253 0.6113 0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0
  13476. 1.0589 -0.7316 -0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0
  13477. -0.5180 -2.1824 -0.3486 H 0 0 0 0 0 0 0 0 0 0 0 0
  13478. -2.3238 -0.4784 -0.0579 H 0 0 0 0 0 0 0 0 0 0 0 0
  13479. -1.6631 1.9006 0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0
  13480. 2.3464 0.9780 0.1385 H 0 0 0 0 0 0 0 0 0 0 0 0
  13481. 1.8678 -1.4428 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0
  13482. 1 2 2 0
  13483. 2 3 1 0
  13484. 3 4 2 0
  13485. 4 5 1 0
  13486. 5 6 2 0
  13487. 6 1 1 0
  13488. 1 7 1 0
  13489. 2 8 1 0
  13490. 3 9 1 0
  13491. 5 10 1 0
  13492. 6 11 1 0
  13493. M END
  13494. $$$$
  13495. RDKit 3D
  13496. 11 11 0 0 0 0 0 0 0 0999 V2000
  13497. -0.2702 -1.1370 -0.1889 C 0 0 0 0 0 0 0 0 0 0 0 0
  13498. -1.2785 -0.1936 -0.0218 C 0 0 0 0 0 0 0 0 0 0 0 0
  13499. -0.9129 1.1251 0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0
  13500. 0.3682 1.5495 0.2575 N 0 0 0 0 0 0 0 0 0 0 0 0
  13501. 1.3253 0.6107 0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
  13502. 1.0589 -0.7308 -0.1318 C 0 0 0 0 0 0 0 0 0 0 0 0
  13503. -0.5180 -2.1802 -0.3623 H 0 0 0 0 0 0 0 0 0 0 0 0
  13504. -2.3238 -0.4780 -0.0609 H 0 0 0 0 0 0 0 0 0 0 0 0
  13505. -1.6631 1.8985 0.3332 H 0 0 0 0 0 0 0 0 0 0 0 0
  13506. 2.3464 0.9771 0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0
  13507. 1.8678 -1.4412 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  13508. 1 2 2 0
  13509. 2 3 1 0
  13510. 3 4 2 0
  13511. 4 5 1 0
  13512. 5 6 2 0
  13513. 6 1 1 0
  13514. 1 7 1 0
  13515. 2 8 1 0
  13516. 3 9 1 0
  13517. 5 10 1 0
  13518. 6 11 1 0
  13519. M END
  13520. $$$$
  13521. RDKit 3D
  13522. 11 11 0 0 0 0 0 0 0 0999 V2000
  13523. -0.2702 -1.1358 -0.1961 C 0 0 0 0 0 0 0 0 0 0 0 0
  13524. -1.2785 -0.1935 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  13525. -0.9129 1.1238 0.2039 C 0 0 0 0 0 0 0 0 0 0 0 0
  13526. 0.3682 1.5478 0.2672 N 0 0 0 0 0 0 0 0 0 0 0 0
  13527. 1.3253 0.6101 0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0
  13528. 1.0589 -0.7299 -0.1364 C 0 0 0 0 0 0 0 0 0 0 0 0
  13529. -0.5180 -2.1779 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0
  13530. -2.3238 -0.4776 -0.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
  13531. -1.6631 1.8964 0.3451 H 0 0 0 0 0 0 0 0 0 0 0 0
  13532. 2.3464 0.9762 0.1507 H 0 0 0 0 0 0 0 0 0 0 0 0
  13533. 1.8678 -1.4396 -0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0
  13534. 1 2 2 0
  13535. 2 3 1 0
  13536. 3 4 2 0
  13537. 4 5 1 0
  13538. 5 6 2 0
  13539. 6 1 1 0
  13540. 1 7 1 0
  13541. 2 8 1 0
  13542. 3 9 1 0
  13543. 5 10 1 0
  13544. 6 11 1 0
  13545. M END
  13546. $$$$
  13547. RDKit 3D
  13548. 11 11 0 0 0 0 0 0 0 0999 V2000
  13549. -0.2702 -1.1346 -0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0
  13550. -1.2785 -0.1933 -0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0
  13551. -0.9129 1.1225 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0
  13552. 0.3682 1.5461 0.2769 N 0 0 0 0 0 0 0 0 0 0 0 0
  13553. 1.3253 0.6095 0.0992 C 0 0 0 0 0 0 0 0 0 0 0 0
  13554. 1.0589 -0.7290 -0.1409 C 0 0 0 0 0 0 0 0 0 0 0 0
  13555. -0.5180 -2.1755 -0.3896 H 0 0 0 0 0 0 0 0 0 0 0 0
  13556. -2.3238 -0.4772 -0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0
  13557. -1.6631 1.8942 0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0
  13558. 2.3464 0.9752 0.1569 H 0 0 0 0 0 0 0 0 0 0 0 0
  13559. 1.8678 -1.4379 -0.2761 H 0 0 0 0 0 0 0 0 0 0 0 0
  13560. 1 2 2 0
  13561. 2 3 1 0
  13562. 3 4 2 0
  13563. 4 5 1 0
  13564. 5 6 2 0
  13565. 6 1 1 0
  13566. 1 7 1 0
  13567. 2 8 1 0
  13568. 3 9 1 0
  13569. 5 10 1 0
  13570. 6 11 1 0
  13571. M END
  13572. $$$$
  13573. RDKit 3D
  13574. 11 11 0 0 0 0 0 0 0 0999 V2000
  13575. -0.2702 -1.1333 -0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0
  13576. -1.2785 -0.1932 -0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0
  13577. -0.9129 1.1212 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
  13578. 0.3682 1.5444 0.2866 N 0 0 0 0 0 0 0 0 0 0 0 0
  13579. 1.3253 0.6089 0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0
  13580. 1.0589 -0.7281 -0.1455 C 0 0 0 0 0 0 0 0 0 0 0 0
  13581. -0.5180 -2.1730 -0.4033 H 0 0 0 0 0 0 0 0 0 0 0 0
  13582. -2.3238 -0.4768 -0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0
  13583. -1.6631 1.8919 0.3689 H 0 0 0 0 0 0 0 0 0 0 0 0
  13584. 2.3464 0.9742 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  13585. 1.8678 -1.4361 -0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0
  13586. 1 2 2 0
  13587. 2 3 1 0
  13588. 3 4 2 0
  13589. 4 5 1 0
  13590. 5 6 2 0
  13591. 6 1 1 0
  13592. 1 7 1 0
  13593. 2 8 1 0
  13594. 3 9 1 0
  13595. 5 10 1 0
  13596. 6 11 1 0
  13597. M END
  13598. $$$$
  13599. RDKit 3D
  13600. 11 11 0 0 0 0 0 0 0 0999 V2000
  13601. -0.2702 -1.1319 -0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0
  13602. -1.2785 -0.1930 -0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0
  13603. -0.9129 1.1198 0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0
  13604. 0.3682 1.5425 0.2963 N 0 0 0 0 0 0 0 0 0 0 0 0
  13605. 1.3253 0.6082 0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0
  13606. 1.0589 -0.7272 -0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0
  13607. -0.5180 -2.1704 -0.4169 H 0 0 0 0 0 0 0 0 0 0 0 0
  13608. -2.3238 -0.4764 -0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0
  13609. -1.6631 1.8895 0.3808 H 0 0 0 0 0 0 0 0 0 0 0 0
  13610. 2.3464 0.9732 0.1691 H 0 0 0 0 0 0 0 0 0 0 0 0
  13611. 1.8678 -1.4343 -0.2942 H 0 0 0 0 0 0 0 0 0 0 0 0
  13612. 1 2 2 0
  13613. 2 3 1 0
  13614. 3 4 2 0
  13615. 4 5 1 0
  13616. 5 6 2 0
  13617. 6 1 1 0
  13618. 1 7 1 0
  13619. 2 8 1 0
  13620. 3 9 1 0
  13621. 5 10 1 0
  13622. 6 11 1 0
  13623. M END
  13624. $$$$
  13625. RDKit 3D
  13626. 11 11 0 0 0 0 0 0 0 0999 V2000
  13627. -0.2702 -1.1306 -0.2246 C 0 0 0 0 0 0 0 0 0 0 0 0
  13628. -1.2785 -0.1928 -0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0
  13629. -0.9129 1.1183 0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
  13630. 0.3682 1.5406 0.3060 N 0 0 0 0 0 0 0 0 0 0 0 0
  13631. 1.3253 0.6076 0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
  13632. 1.0589 -0.7263 -0.1547 C 0 0 0 0 0 0 0 0 0 0 0 0
  13633. -0.5180 -2.1678 -0.4306 H 0 0 0 0 0 0 0 0 0 0 0 0
  13634. -2.3238 -0.4759 -0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0
  13635. -1.6631 1.8871 0.3927 H 0 0 0 0 0 0 0 0 0 0 0 0
  13636. 2.3464 0.9721 0.1752 H 0 0 0 0 0 0 0 0 0 0 0 0
  13637. 1.8678 -1.4324 -0.3032 H 0 0 0 0 0 0 0 0 0 0 0 0
  13638. 1 2 2 0
  13639. 2 3 1 0
  13640. 3 4 2 0
  13641. 4 5 1 0
  13642. 5 6 2 0
  13643. 6 1 1 0
  13644. 1 7 1 0
  13645. 2 8 1 0
  13646. 3 9 1 0
  13647. 5 10 1 0
  13648. 6 11 1 0
  13649. M END
  13650. $$$$
  13651. RDKit 3D
  13652. 11 11 0 0 0 0 0 0 0 0999 V2000
  13653. -0.2702 -1.1291 -0.2317 C 0 0 0 0 0 0 0 0 0 0 0 0
  13654. -1.2785 -0.1927 -0.0291 C 0 0 0 0 0 0 0 0 0 0 0 0
  13655. -0.9129 1.1168 0.2391 C 0 0 0 0 0 0 0 0 0 0 0 0
  13656. 0.3682 1.5387 0.3157 N 0 0 0 0 0 0 0 0 0 0 0 0
  13657. 1.3253 0.6068 0.1145 C 0 0 0 0 0 0 0 0 0 0 0 0
  13658. 1.0589 -0.7253 -0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0
  13659. -0.5180 -2.1650 -0.4442 H 0 0 0 0 0 0 0 0 0 0 0 0
  13660. -2.3238 -0.4754 -0.0788 H 0 0 0 0 0 0 0 0 0 0 0 0
  13661. -1.6631 1.8846 0.4045 H 0 0 0 0 0 0 0 0 0 0 0 0
  13662. 2.3464 0.9710 0.1813 H 0 0 0 0 0 0 0 0 0 0 0 0
  13663. 1.8678 -1.4305 -0.3122 H 0 0 0 0 0 0 0 0 0 0 0 0
  13664. 1 2 2 0
  13665. 2 3 1 0
  13666. 3 4 2 0
  13667. 4 5 1 0
  13668. 5 6 2 0
  13669. 6 1 1 0
  13670. 1 7 1 0
  13671. 2 8 1 0
  13672. 3 9 1 0
  13673. 5 10 1 0
  13674. 6 11 1 0
  13675. M END
  13676. $$$$
  13677. RDKit 3D
  13678. 11 11 0 0 0 0 0 0 0 0999 V2000
  13679. -0.2702 -1.1276 -0.2387 C 0 0 0 0 0 0 0 0 0 0 0 0
  13680. -1.2785 -0.1925 -0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0
  13681. -0.9129 1.1153 0.2461 C 0 0 0 0 0 0 0 0 0 0 0 0
  13682. 0.3682 1.5367 0.3253 N 0 0 0 0 0 0 0 0 0 0 0 0
  13683. 1.3253 0.6061 0.1183 C 0 0 0 0 0 0 0 0 0 0 0 0
  13684. 1.0589 -0.7243 -0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0
  13685. -0.5180 -2.1622 -0.4578 H 0 0 0 0 0 0 0 0 0 0 0 0
  13686. -2.3238 -0.4749 -0.0818 H 0 0 0 0 0 0 0 0 0 0 0 0
  13687. -1.6631 1.8820 0.4164 H 0 0 0 0 0 0 0 0 0 0 0 0
  13688. 2.3464 0.9698 0.1874 H 0 0 0 0 0 0 0 0 0 0 0 0
  13689. 1.8678 -1.4285 -0.3212 H 0 0 0 0 0 0 0 0 0 0 0 0
  13690. 1 2 2 0
  13691. 2 3 1 0
  13692. 3 4 2 0
  13693. 4 5 1 0
  13694. 5 6 2 0
  13695. 6 1 1 0
  13696. 1 7 1 0
  13697. 2 8 1 0
  13698. 3 9 1 0
  13699. 5 10 1 0
  13700. 6 11 1 0
  13701. M END
  13702. $$$$
  13703. RDKit 3D
  13704. 11 11 0 0 0 0 0 0 0 0999 V2000
  13705. -0.2702 -1.1261 -0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0
  13706. -1.2785 -0.1923 -0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0
  13707. -0.9129 1.1137 0.2531 C 0 0 0 0 0 0 0 0 0 0 0 0
  13708. 0.3682 1.5346 0.3350 N 0 0 0 0 0 0 0 0 0 0 0 0
  13709. 1.3253 0.6054 0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0
  13710. 1.0589 -0.7232 -0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
  13711. -0.5180 -2.1593 -0.4714 H 0 0 0 0 0 0 0 0 0 0 0 0
  13712. -2.3238 -0.4744 -0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0
  13713. -1.6631 1.8794 0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0
  13714. 2.3464 0.9686 0.1935 H 0 0 0 0 0 0 0 0 0 0 0 0
  13715. 1.8678 -1.4265 -0.3301 H 0 0 0 0 0 0 0 0 0 0 0 0
  13716. 1 2 2 0
  13717. 2 3 1 0
  13718. 3 4 2 0
  13719. 4 5 1 0
  13720. 5 6 2 0
  13721. 6 1 1 0
  13722. 1 7 1 0
  13723. 2 8 1 0
  13724. 3 9 1 0
  13725. 5 10 1 0
  13726. 6 11 1 0
  13727. M END
  13728. $$$$
  13729. RDKit 3D
  13730. 11 11 0 0 0 0 0 0 0 0999 V2000
  13731. -0.2702 -1.1246 -0.2529 C 0 0 0 0 0 0 0 0 0 0 0 0
  13732. -1.2785 -0.1921 -0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0
  13733. -0.9129 1.1121 0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0
  13734. 0.3682 1.5325 0.3446 N 0 0 0 0 0 0 0 0 0 0 0 0
  13735. 1.3253 0.6046 0.1259 C 0 0 0 0 0 0 0 0 0 0 0 0
  13736. 1.0589 -0.7221 -0.1729 C 0 0 0 0 0 0 0 0 0 0 0 0
  13737. -0.5180 -2.1563 -0.4849 H 0 0 0 0 0 0 0 0 0 0 0 0
  13738. -2.3238 -0.4738 -0.0878 H 0 0 0 0 0 0 0 0 0 0 0 0
  13739. -1.6631 1.8766 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  13740. 2.3464 0.9674 0.1996 H 0 0 0 0 0 0 0 0 0 0 0 0
  13741. 1.8678 -1.4244 -0.3391 H 0 0 0 0 0 0 0 0 0 0 0 0
  13742. 1 2 2 0
  13743. 2 3 1 0
  13744. 3 4 2 0
  13745. 4 5 1 0
  13746. 5 6 2 0
  13747. 6 1 1 0
  13748. 1 7 1 0
  13749. 2 8 1 0
  13750. 3 9 1 0
  13751. 5 10 1 0
  13752. 6 11 1 0
  13753. M END
  13754. $$$$
  13755. RDKit 3D
  13756. 11 11 0 0 0 0 0 0 0 0999 V2000
  13757. -0.2702 -1.1229 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0
  13758. -1.2785 -0.1919 -0.0339 C 0 0 0 0 0 0 0 0 0 0 0 0
  13759. -0.9129 1.1105 0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0
  13760. 0.3682 1.5303 0.3543 N 0 0 0 0 0 0 0 0 0 0 0 0
  13761. 1.3253 0.6038 0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  13762. 1.0589 -0.7210 -0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0
  13763. -0.5180 -2.1532 -0.4985 H 0 0 0 0 0 0 0 0 0 0 0 0
  13764. -2.3238 -0.4733 -0.0908 H 0 0 0 0 0 0 0 0 0 0 0 0
  13765. -1.6631 1.8738 0.4518 H 0 0 0 0 0 0 0 0 0 0 0 0
  13766. 2.3464 0.9661 0.2057 H 0 0 0 0 0 0 0 0 0 0 0 0
  13767. 1.8678 -1.4222 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0
  13768. 1 2 2 0
  13769. 2 3 1 0
  13770. 3 4 2 0
  13771. 4 5 1 0
  13772. 5 6 2 0
  13773. 6 1 1 0
  13774. 1 7 1 0
  13775. 2 8 1 0
  13776. 3 9 1 0
  13777. 5 10 1 0
  13778. 6 11 1 0
  13779. M END
  13780. $$$$
  13781. RDKit 3D
  13782. 11 11 0 0 0 0 0 0 0 0999 V2000
  13783. -0.2702 -1.1213 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0
  13784. -1.2785 -0.1917 -0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0
  13785. -0.9129 1.1088 0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0
  13786. 0.3682 1.5280 0.3639 N 0 0 0 0 0 0 0 0 0 0 0 0
  13787. 1.3253 0.6030 0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
  13788. 1.0589 -0.7199 -0.1819 C 0 0 0 0 0 0 0 0 0 0 0 0
  13789. -0.5180 -2.1500 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0
  13790. -2.3238 -0.4727 -0.0937 H 0 0 0 0 0 0 0 0 0 0 0 0
  13791. -1.6631 1.8710 0.4635 H 0 0 0 0 0 0 0 0 0 0 0 0
  13792. 2.3464 0.9648 0.2117 H 0 0 0 0 0 0 0 0 0 0 0 0
  13793. 1.8678 -1.4200 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0
  13794. 1 2 2 0
  13795. 2 3 1 0
  13796. 3 4 2 0
  13797. 4 5 1 0
  13798. 5 6 2 0
  13799. 6 1 1 0
  13800. 1 7 1 0
  13801. 2 8 1 0
  13802. 3 9 1 0
  13803. 5 10 1 0
  13804. 6 11 1 0
  13805. M END
  13806. $$$$
  13807. RDKit 3D
  13808. 11 11 0 0 0 0 0 0 0 0999 V2000
  13809. -0.2702 -1.1196 -0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0
  13810. -1.2785 -0.1914 -0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0
  13811. -0.9129 1.1070 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0
  13812. 0.3682 1.5257 0.3735 N 0 0 0 0 0 0 0 0 0 0 0 0
  13813. 1.3253 0.6021 0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0
  13814. 1.0589 -0.7188 -0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0
  13815. -0.5180 -2.1467 -0.5255 H 0 0 0 0 0 0 0 0 0 0 0 0
  13816. -2.3238 -0.4721 -0.0967 H 0 0 0 0 0 0 0 0 0 0 0 0
  13817. -1.6631 1.8680 0.4753 H 0 0 0 0 0 0 0 0 0 0 0 0
  13818. 2.3464 0.9635 0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0
  13819. 1.8678 -1.4177 -0.3659 H 0 0 0 0 0 0 0 0 0 0 0 0
  13820. 1 2 2 0
  13821. 2 3 1 0
  13822. 3 4 2 0
  13823. 4 5 1 0
  13824. 5 6 2 0
  13825. 6 1 1 0
  13826. 1 7 1 0
  13827. 2 8 1 0
  13828. 3 9 1 0
  13829. 5 10 1 0
  13830. 6 11 1 0
  13831. M END
  13832. $$$$
  13833. RDKit 3D
  13834. 11 11 0 0 0 0 0 0 0 0999 V2000
  13835. -0.2702 -1.1178 -0.2811 C 0 0 0 0 0 0 0 0 0 0 0 0
  13836. -1.2785 -0.1912 -0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
  13837. -0.9129 1.1052 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  13838. 0.3682 1.5233 0.3830 N 0 0 0 0 0 0 0 0 0 0 0 0
  13839. 1.3253 0.6012 0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0
  13840. 1.0589 -0.7176 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
  13841. -0.5180 -2.1434 -0.5389 H 0 0 0 0 0 0 0 0 0 0 0 0
  13842. -2.3238 -0.4715 -0.0997 H 0 0 0 0 0 0 0 0 0 0 0 0
  13843. -1.6631 1.8650 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0
  13844. 2.3464 0.9621 0.2239 H 0 0 0 0 0 0 0 0 0 0 0 0
  13845. 1.8678 -1.4154 -0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0
  13846. 1 2 2 0
  13847. 2 3 1 0
  13848. 3 4 2 0
  13849. 4 5 1 0
  13850. 5 6 2 0
  13851. 6 1 1 0
  13852. 1 7 1 0
  13853. 2 8 1 0
  13854. 3 9 1 0
  13855. 5 10 1 0
  13856. 6 11 1 0
  13857. M END
  13858. $$$$
  13859. RDKit 3D
  13860. 11 11 0 0 0 0 0 0 0 0999 V2000
  13861. -0.2702 -1.1161 -0.2881 C 0 0 0 0 0 0 0 0 0 0 0 0
  13862. -1.2785 -0.1910 -0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0
  13863. -0.9129 1.1034 0.2949 C 0 0 0 0 0 0 0 0 0 0 0 0
  13864. 0.3682 1.5209 0.3926 N 0 0 0 0 0 0 0 0 0 0 0 0
  13865. 1.3253 0.6003 0.1449 C 0 0 0 0 0 0 0 0 0 0 0 0
  13866. 1.0589 -0.7164 -0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0
  13867. -0.5180 -2.1400 -0.5524 H 0 0 0 0 0 0 0 0 0 0 0 0
  13868. -2.3238 -0.4708 -0.1026 H 0 0 0 0 0 0 0 0 0 0 0 0
  13869. -1.6631 1.8619 0.4987 H 0 0 0 0 0 0 0 0 0 0 0 0
  13870. 2.3464 0.9607 0.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
  13871. 1.8678 -1.4130 -0.3837 H 0 0 0 0 0 0 0 0 0 0 0 0
  13872. 1 2 2 0
  13873. 2 3 1 0
  13874. 3 4 2 0
  13875. 4 5 1 0
  13876. 5 6 2 0
  13877. 6 1 1 0
  13878. 1 7 1 0
  13879. 2 8 1 0
  13880. 3 9 1 0
  13881. 5 10 1 0
  13882. 6 11 1 0
  13883. M END
  13884. $$$$
  13885. RDKit 3D
  13886. 11 11 0 0 0 0 0 0 0 0999 V2000
  13887. -0.2702 -1.1142 -0.2951 C 0 0 0 0 0 0 0 0 0 0 0 0
  13888. -1.2785 -0.1907 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  13889. -0.9129 1.1015 0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0
  13890. 0.3682 1.5184 0.4021 N 0 0 0 0 0 0 0 0 0 0 0 0
  13891. 1.3253 0.5994 0.1486 C 0 0 0 0 0 0 0 0 0 0 0 0
  13892. 1.0589 -0.7151 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0
  13893. -0.5180 -2.1364 -0.5658 H 0 0 0 0 0 0 0 0 0 0 0 0
  13894. -2.3238 -0.4702 -0.1056 H 0 0 0 0 0 0 0 0 0 0 0 0
  13895. -1.6631 1.8587 0.5104 H 0 0 0 0 0 0 0 0 0 0 0 0
  13896. 2.3464 0.9592 0.2359 H 0 0 0 0 0 0 0 0 0 0 0 0
  13897. 1.8678 -1.4106 -0.3925 H 0 0 0 0 0 0 0 0 0 0 0 0
  13898. 1 2 2 0
  13899. 2 3 1 0
  13900. 3 4 2 0
  13901. 4 5 1 0
  13902. 5 6 2 0
  13903. 6 1 1 0
  13904. 1 7 1 0
  13905. 2 8 1 0
  13906. 3 9 1 0
  13907. 5 10 1 0
  13908. 6 11 1 0
  13909. M END
  13910. $$$$
  13911. RDKit 3D
  13912. 11 11 0 0 0 0 0 0 0 0999 V2000
  13913. -0.2702 -1.1123 -0.3021 C 0 0 0 0 0 0 0 0 0 0 0 0
  13914. -1.2785 -0.1905 -0.0411 C 0 0 0 0 0 0 0 0 0 0 0 0
  13915. -0.9129 1.0996 0.3088 C 0 0 0 0 0 0 0 0 0 0 0 0
  13916. 0.3682 1.5158 0.4117 N 0 0 0 0 0 0 0 0 0 0 0 0
  13917. 1.3253 0.5985 0.1524 C 0 0 0 0 0 0 0 0 0 0 0 0
  13918. 1.0589 -0.7138 -0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0
  13919. -0.5180 -2.1328 -0.5793 H 0 0 0 0 0 0 0 0 0 0 0 0
  13920. -2.3238 -0.4695 -0.1085 H 0 0 0 0 0 0 0 0 0 0 0 0
  13921. -1.6631 1.8555 0.5221 H 0 0 0 0 0 0 0 0 0 0 0 0
  13922. 2.3464 0.9577 0.2419 H 0 0 0 0 0 0 0 0 0 0 0 0
  13923. 1.8678 -1.4081 -0.4014 H 0 0 0 0 0 0 0 0 0 0 0 0
  13924. 1 2 2 0
  13925. 2 3 1 0
  13926. 3 4 2 0
  13927. 4 5 1 0
  13928. 5 6 2 0
  13929. 6 1 1 0
  13930. 1 7 1 0
  13931. 2 8 1 0
  13932. 3 9 1 0
  13933. 5 10 1 0
  13934. 6 11 1 0
  13935. M END
  13936. $$$$
  13937. RDKit 3D
  13938. 11 11 0 0 0 0 0 0 0 0999 V2000
  13939. -0.2702 -1.1104 -0.3091 C 0 0 0 0 0 0 0 0 0 0 0 0
  13940. -1.2785 -0.1902 -0.0423 C 0 0 0 0 0 0 0 0 0 0 0 0
  13941. -0.9129 1.0977 0.3157 C 0 0 0 0 0 0 0 0 0 0 0 0
  13942. 0.3682 1.5132 0.4212 N 0 0 0 0 0 0 0 0 0 0 0 0
  13943. 1.3253 0.5975 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0
  13944. 1.0589 -0.7125 -0.2089 C 0 0 0 0 0 0 0 0 0 0 0 0
  13945. -0.5180 -2.1292 -0.5926 H 0 0 0 0 0 0 0 0 0 0 0 0
  13946. -2.3238 -0.4688 -0.1115 H 0 0 0 0 0 0 0 0 0 0 0 0
  13947. -1.6631 1.8522 0.5337 H 0 0 0 0 0 0 0 0 0 0 0 0
  13948. 2.3464 0.9562 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
  13949. 1.8678 -1.4055 -0.4102 H 0 0 0 0 0 0 0 0 0 0 0 0
  13950. 1 2 2 0
  13951. 2 3 1 0
  13952. 3 4 2 0
  13953. 4 5 1 0
  13954. 5 6 2 0
  13955. 6 1 1 0
  13956. 1 7 1 0
  13957. 2 8 1 0
  13958. 3 9 1 0
  13959. 5 10 1 0
  13960. 6 11 1 0
  13961. M END
  13962. $$$$
  13963. RDKit 3D
  13964. 11 11 0 0 0 0 0 0 0 0999 V2000
  13965. -0.2702 -1.1085 -0.3161 C 0 0 0 0 0 0 0 0 0 0 0 0
  13966. -1.2785 -0.1899 -0.0435 C 0 0 0 0 0 0 0 0 0 0 0 0
  13967. -0.9129 1.0957 0.3226 C 0 0 0 0 0 0 0 0 0 0 0 0
  13968. 0.3682 1.5105 0.4307 N 0 0 0 0 0 0 0 0 0 0 0 0
  13969. 1.3253 0.5965 0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0
  13970. 1.0589 -0.7112 -0.2134 C 0 0 0 0 0 0 0 0 0 0 0 0
  13971. -0.5180 -2.1254 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
  13972. -2.3238 -0.4681 -0.1144 H 0 0 0 0 0 0 0 0 0 0 0 0
  13973. -1.6631 1.8488 0.5454 H 0 0 0 0 0 0 0 0 0 0 0 0
  13974. 2.3464 0.9546 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  13975. 1.8678 -1.4029 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0
  13976. 1 2 2 0
  13977. 2 3 1 0
  13978. 3 4 2 0
  13979. 4 5 1 0
  13980. 5 6 2 0
  13981. 6 1 1 0
  13982. 1 7 1 0
  13983. 2 8 1 0
  13984. 3 9 1 0
  13985. 5 10 1 0
  13986. 6 11 1 0
  13987. M END
  13988. $$$$
  13989. RDKit 3D
  13990. 11 11 0 0 0 0 0 0 0 0999 V2000
  13991. -0.2702 -1.1065 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0
  13992. -1.2785 -0.1896 -0.0447 C 0 0 0 0 0 0 0 0 0 0 0 0
  13993. -0.9129 1.0936 0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0
  13994. 0.3682 1.5078 0.4402 N 0 0 0 0 0 0 0 0 0 0 0 0
  13995. 1.3253 0.5955 0.1637 C 0 0 0 0 0 0 0 0 0 0 0 0
  13996. 1.0589 -0.7099 -0.2179 C 0 0 0 0 0 0 0 0 0 0 0 0
  13997. -0.5180 -2.1216 -0.6193 H 0 0 0 0 0 0 0 0 0 0 0 0
  13998. -2.3238 -0.4674 -0.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
  13999. -1.6631 1.8453 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
  14000. 2.3464 0.9530 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0
  14001. 1.8678 -1.4003 -0.4279 H 0 0 0 0 0 0 0 0 0 0 0 0
  14002. 1 2 2 0
  14003. 2 3 1 0
  14004. 3 4 2 0
  14005. 4 5 1 0
  14006. 5 6 2 0
  14007. 6 1 1 0
  14008. 1 7 1 0
  14009. 2 8 1 0
  14010. 3 9 1 0
  14011. 5 10 1 0
  14012. 6 11 1 0
  14013. M END
  14014. $$$$
  14015. RDKit 3D
  14016. 11 11 0 0 0 0 0 0 0 0999 V2000
  14017. -0.2702 -1.1044 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
  14018. -1.2785 -0.1894 -0.0459 C 0 0 0 0 0 0 0 0 0 0 0 0
  14019. -0.9129 1.0915 0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0
  14020. 0.3682 1.5050 0.4496 N 0 0 0 0 0 0 0 0 0 0 0 0
  14021. 1.3253 0.5944 0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0
  14022. 1.0589 -0.7085 -0.2223 C 0 0 0 0 0 0 0 0 0 0 0 0
  14023. -0.5180 -2.1176 -0.6327 H 0 0 0 0 0 0 0 0 0 0 0 0
  14024. -2.3238 -0.4666 -0.1203 H 0 0 0 0 0 0 0 0 0 0 0 0
  14025. -1.6631 1.8418 0.5685 H 0 0 0 0 0 0 0 0 0 0 0 0
  14026. 2.3464 0.9513 0.2659 H 0 0 0 0 0 0 0 0 0 0 0 0
  14027. 1.8678 -1.3975 -0.4366 H 0 0 0 0 0 0 0 0 0 0 0 0
  14028. 1 2 2 0
  14029. 2 3 1 0
  14030. 3 4 2 0
  14031. 4 5 1 0
  14032. 5 6 2 0
  14033. 6 1 1 0
  14034. 1 7 1 0
  14035. 2 8 1 0
  14036. 3 9 1 0
  14037. 5 10 1 0
  14038. 6 11 1 0
  14039. M END
  14040. $$$$
  14041. RDKit 3D
  14042. 11 11 0 0 0 0 0 0 0 0999 V2000
  14043. -0.2702 -1.1023 -0.3369 C 0 0 0 0 0 0 0 0 0 0 0 0
  14044. -1.2785 -0.1891 -0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
  14045. -0.9129 1.0894 0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0
  14046. 0.3682 1.5021 0.4591 N 0 0 0 0 0 0 0 0 0 0 0 0
  14047. 1.3253 0.5934 0.1711 C 0 0 0 0 0 0 0 0 0 0 0 0
  14048. 1.0589 -0.7071 -0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0
  14049. -0.5180 -2.1136 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0
  14050. -2.3238 -0.4659 -0.1232 H 0 0 0 0 0 0 0 0 0 0 0 0
  14051. -1.6631 1.8382 0.5801 H 0 0 0 0 0 0 0 0 0 0 0 0
  14052. 2.3464 0.9496 0.2719 H 0 0 0 0 0 0 0 0 0 0 0 0
  14053. 1.8678 -1.3948 -0.4454 H 0 0 0 0 0 0 0 0 0 0 0 0
  14054. 1 2 2 0
  14055. 2 3 1 0
  14056. 3 4 2 0
  14057. 4 5 1 0
  14058. 5 6 2 0
  14059. 6 1 1 0
  14060. 1 7 1 0
  14061. 2 8 1 0
  14062. 3 9 1 0
  14063. 5 10 1 0
  14064. 6 11 1 0
  14065. M END
  14066. $$$$
  14067. RDKit 3D
  14068. 11 11 0 0 0 0 0 0 0 0999 V2000
  14069. -0.2702 -1.1002 -0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0
  14070. -1.2785 -0.1888 -0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0
  14071. -0.9129 1.0872 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0
  14072. 0.3682 1.4992 0.4685 N 0 0 0 0 0 0 0 0 0 0 0 0
  14073. 1.3253 0.5923 0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0
  14074. 1.0589 -0.7056 -0.2312 C 0 0 0 0 0 0 0 0 0 0 0 0
  14075. -0.5180 -2.1095 -0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0
  14076. -2.3238 -0.4651 -0.1262 H 0 0 0 0 0 0 0 0 0 0 0 0
  14077. -1.6631 1.8345 0.5916 H 0 0 0 0 0 0 0 0 0 0 0 0
  14078. 2.3464 0.9479 0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
  14079. 1.8678 -1.3919 -0.4542 H 0 0 0 0 0 0 0 0 0 0 0 0
  14080. 1 2 2 0
  14081. 2 3 1 0
  14082. 3 4 2 0
  14083. 4 5 1 0
  14084. 5 6 2 0
  14085. 6 1 1 0
  14086. 1 7 1 0
  14087. 2 8 1 0
  14088. 3 9 1 0
  14089. 5 10 1 0
  14090. 6 11 1 0
  14091. M END
  14092. $$$$
  14093. RDKit 3D
  14094. 11 11 0 0 0 0 0 0 0 0999 V2000
  14095. -0.2702 -1.0980 -0.3507 C 0 0 0 0 0 0 0 0 0 0 0 0
  14096. -1.2785 -0.1885 -0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0
  14097. -0.9129 1.0850 0.3568 C 0 0 0 0 0 0 0 0 0 0 0 0
  14098. 0.3682 1.4963 0.4779 N 0 0 0 0 0 0 0 0 0 0 0 0
  14099. 1.3253 0.5912 0.1786 C 0 0 0 0 0 0 0 0 0 0 0 0
  14100. 1.0589 -0.7042 -0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0
  14101. -0.5180 -2.1053 -0.6725 H 0 0 0 0 0 0 0 0 0 0 0 0
  14102. -2.3238 -0.4643 -0.1291 H 0 0 0 0 0 0 0 0 0 0 0 0
  14103. -1.6631 1.8307 0.6032 H 0 0 0 0 0 0 0 0 0 0 0 0
  14104. 2.3464 0.9461 0.2838 H 0 0 0 0 0 0 0 0 0 0 0 0
  14105. 1.8678 -1.3891 -0.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
  14106. 1 2 2 0
  14107. 2 3 1 0
  14108. 3 4 2 0
  14109. 4 5 1 0
  14110. 5 6 2 0
  14111. 6 1 1 0
  14112. 1 7 1 0
  14113. 2 8 1 0
  14114. 3 9 1 0
  14115. 5 10 1 0
  14116. 6 11 1 0
  14117. M END
  14118. $$$$
  14119. RDKit 3D
  14120. 11 11 0 0 0 0 0 0 0 0999 V2000
  14121. -0.2702 -1.0958 -0.3576 C 0 0 0 0 0 0 0 0 0 0 0 0
  14122. -1.2785 -0.1882 -0.0507 C 0 0 0 0 0 0 0 0 0 0 0 0
  14123. -0.9129 1.0827 0.3636 C 0 0 0 0 0 0 0 0 0 0 0 0
  14124. 0.3682 1.4932 0.4873 N 0 0 0 0 0 0 0 0 0 0 0 0
  14125. 1.3253 0.5900 0.1823 C 0 0 0 0 0 0 0 0 0 0 0 0
  14126. 1.0589 -0.7027 -0.2401 C 0 0 0 0 0 0 0 0 0 0 0 0
  14127. -0.5180 -2.1010 -0.6857 H 0 0 0 0 0 0 0 0 0 0 0 0
  14128. -2.3238 -0.4635 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0
  14129. -1.6631 1.8269 0.6146 H 0 0 0 0 0 0 0 0 0 0 0 0
  14130. 2.3464 0.9443 0.2898 H 0 0 0 0 0 0 0 0 0 0 0 0
  14131. 1.8678 -1.3861 -0.4716 H 0 0 0 0 0 0 0 0 0 0 0 0
  14132. 1 2 2 0
  14133. 2 3 1 0
  14134. 3 4 2 0
  14135. 4 5 1 0
  14136. 5 6 2 0
  14137. 6 1 1 0
  14138. 1 7 1 0
  14139. 2 8 1 0
  14140. 3 9 1 0
  14141. 5 10 1 0
  14142. 6 11 1 0
  14143. M END
  14144. $$$$
  14145. RDKit 3D
  14146. 11 11 0 0 0 0 0 0 0 0999 V2000
  14147. -0.2702 -1.0935 -0.3645 C 0 0 0 0 0 0 0 0 0 0 0 0
  14148. -1.2785 -0.1878 -0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0
  14149. -0.9129 1.0804 0.3704 C 0 0 0 0 0 0 0 0 0 0 0 0
  14150. 0.3682 1.4901 0.4967 N 0 0 0 0 0 0 0 0 0 0 0 0
  14151. 1.3253 0.5889 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  14152. 1.0589 -0.7011 -0.2445 C 0 0 0 0 0 0 0 0 0 0 0 0
  14153. -0.5180 -2.0967 -0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
  14154. -2.3238 -0.4626 -0.1349 H 0 0 0 0 0 0 0 0 0 0 0 0
  14155. -1.6631 1.8230 0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0
  14156. 2.3464 0.9425 0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0
  14157. 1.8678 -1.3831 -0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
  14158. 1 2 2 0
  14159. 2 3 1 0
  14160. 3 4 2 0
  14161. 4 5 1 0
  14162. 5 6 2 0
  14163. 6 1 1 0
  14164. 1 7 1 0
  14165. 2 8 1 0
  14166. 3 9 1 0
  14167. 5 10 1 0
  14168. 6 11 1 0
  14169. M END
  14170. $$$$
  14171. RDKit 3D
  14172. 11 11 0 0 0 0 0 0 0 0999 V2000
  14173. -0.2702 -1.0912 -0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0
  14174. -1.2785 -0.1875 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  14175. -0.9129 1.0781 0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0
  14176. 0.3682 1.4870 0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0
  14177. 1.3253 0.5877 0.1897 C 0 0 0 0 0 0 0 0 0 0 0 0
  14178. 1.0589 -0.6996 -0.2489 C 0 0 0 0 0 0 0 0 0 0 0 0
  14179. -0.5180 -2.0923 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0
  14180. -2.3238 -0.4618 -0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0
  14181. -1.6631 1.8190 0.6376 H 0 0 0 0 0 0 0 0 0 0 0 0
  14182. 2.3464 0.9406 0.3016 H 0 0 0 0 0 0 0 0 0 0 0 0
  14183. 1.8678 -1.3801 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0
  14184. 1 2 2 0
  14185. 2 3 1 0
  14186. 3 4 2 0
  14187. 4 5 1 0
  14188. 5 6 2 0
  14189. 6 1 1 0
  14190. 1 7 1 0
  14191. 2 8 1 0
  14192. 3 9 1 0
  14193. 5 10 1 0
  14194. 6 11 1 0
  14195. M END
  14196. $$$$
  14197. RDKit 3D
  14198. 11 11 0 0 0 0 0 0 0 0999 V2000
  14199. -0.2702 -1.0888 -0.3782 C 0 0 0 0 0 0 0 0 0 0 0 0
  14200. -1.2785 -0.1872 -0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0
  14201. -0.9129 1.0757 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0
  14202. 0.3682 1.4838 0.5154 N 0 0 0 0 0 0 0 0 0 0 0 0
  14203. 1.3253 0.5865 0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0
  14204. 1.0589 -0.6980 -0.2533 C 0 0 0 0 0 0 0 0 0 0 0 0
  14205. -0.5180 -2.0878 -0.7252 H 0 0 0 0 0 0 0 0 0 0 0 0
  14206. -2.3238 -0.4609 -0.1407 H 0 0 0 0 0 0 0 0 0 0 0 0
  14207. -1.6631 1.8150 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0
  14208. 2.3464 0.9387 0.3075 H 0 0 0 0 0 0 0 0 0 0 0 0
  14209. 1.8678 -1.3770 -0.4977 H 0 0 0 0 0 0 0 0 0 0 0 0
  14210. 1 2 2 0
  14211. 2 3 1 0
  14212. 3 4 2 0
  14213. 4 5 1 0
  14214. 5 6 2 0
  14215. 6 1 1 0
  14216. 1 7 1 0
  14217. 2 8 1 0
  14218. 3 9 1 0
  14219. 5 10 1 0
  14220. 6 11 1 0
  14221. M END
  14222. $$$$
  14223. RDKit 3D
  14224. 11 11 0 0 0 0 0 0 0 0999 V2000
  14225. -0.2702 -1.0864 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0
  14226. -1.2785 -0.1868 -0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0
  14227. -0.9129 1.0732 0.3907 C 0 0 0 0 0 0 0 0 0 0 0 0
  14228. 0.3682 1.4805 0.5247 N 0 0 0 0 0 0 0 0 0 0 0 0
  14229. 1.3253 0.5853 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
  14230. 1.0589 -0.6964 -0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0
  14231. -0.5180 -2.0832 -0.7383 H 0 0 0 0 0 0 0 0 0 0 0 0
  14232. -2.3238 -0.4600 -0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0
  14233. -1.6631 1.8109 0.6604 H 0 0 0 0 0 0 0 0 0 0 0 0
  14234. 2.3464 0.9368 0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0
  14235. 1.8678 -1.3738 -0.5063 H 0 0 0 0 0 0 0 0 0 0 0 0
  14236. 1 2 2 0
  14237. 2 3 1 0
  14238. 3 4 2 0
  14239. 4 5 1 0
  14240. 5 6 2 0
  14241. 6 1 1 0
  14242. 1 7 1 0
  14243. 2 8 1 0
  14244. 3 9 1 0
  14245. 5 10 1 0
  14246. 6 11 1 0
  14247. M END
  14248. $$$$
  14249. RDKit 3D
  14250. 11 11 0 0 0 0 0 0 0 0999 V2000
  14251. -0.2702 -1.0840 -0.3918 C 0 0 0 0 0 0 0 0 0 0 0 0
  14252. -1.2785 -0.1865 -0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0
  14253. -0.9129 1.0708 0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0
  14254. 0.3682 1.4772 0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0
  14255. 1.3253 0.5840 0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0
  14256. 1.0589 -0.6948 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0
  14257. -0.5180 -2.0785 -0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0
  14258. -2.3238 -0.4591 -0.1465 H 0 0 0 0 0 0 0 0 0 0 0 0
  14259. -1.6631 1.8067 0.6717 H 0 0 0 0 0 0 0 0 0 0 0 0
  14260. 2.3464 0.9348 0.3193 H 0 0 0 0 0 0 0 0 0 0 0 0
  14261. 1.8678 -1.3706 -0.5149 H 0 0 0 0 0 0 0 0 0 0 0 0
  14262. 1 2 2 0
  14263. 2 3 1 0
  14264. 3 4 2 0
  14265. 4 5 1 0
  14266. 5 6 2 0
  14267. 6 1 1 0
  14268. 1 7 1 0
  14269. 2 8 1 0
  14270. 3 9 1 0
  14271. 5 10 1 0
  14272. 6 11 1 0
  14273. M END
  14274. $$$$
  14275. RDKit 3D
  14276. 11 11 0 0 0 0 0 0 0 0999 V2000
  14277. -0.2702 -1.0815 -0.3987 C 0 0 0 0 0 0 0 0 0 0 0 0
  14278. -1.2785 -0.1861 -0.0577 C 0 0 0 0 0 0 0 0 0 0 0 0
  14279. -0.9129 1.0682 0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0
  14280. 0.3682 1.4738 0.5433 N 0 0 0 0 0 0 0 0 0 0 0 0
  14281. 1.3253 0.5828 0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0
  14282. 1.0589 -0.6931 -0.2664 C 0 0 0 0 0 0 0 0 0 0 0 0
  14283. -0.5180 -2.0737 -0.7644 H 0 0 0 0 0 0 0 0 0 0 0 0
  14284. -2.3238 -0.4582 -0.1494 H 0 0 0 0 0 0 0 0 0 0 0 0
  14285. -1.6631 1.8024 0.6831 H 0 0 0 0 0 0 0 0 0 0 0 0
  14286. 2.3464 0.9327 0.3251 H 0 0 0 0 0 0 0 0 0 0 0 0
  14287. 1.8678 -1.3674 -0.5235 H 0 0 0 0 0 0 0 0 0 0 0 0
  14288. 1 2 2 0
  14289. 2 3 1 0
  14290. 3 4 2 0
  14291. 4 5 1 0
  14292. 5 6 2 0
  14293. 6 1 1 0
  14294. 1 7 1 0
  14295. 2 8 1 0
  14296. 3 9 1 0
  14297. 5 10 1 0
  14298. 6 11 1 0
  14299. M END
  14300. $$$$
  14301. RDKit 3D
  14302. 11 11 0 0 0 0 0 0 0 0999 V2000
  14303. -0.2702 -1.0790 -0.4054 C 0 0 0 0 0 0 0 0 0 0 0 0
  14304. -1.2785 -0.1857 -0.0589 C 0 0 0 0 0 0 0 0 0 0 0 0
  14305. -0.9129 1.0657 0.4109 C 0 0 0 0 0 0 0 0 0 0 0 0
  14306. 0.3682 1.4703 0.5525 N 0 0 0 0 0 0 0 0 0 0 0 0
  14307. 1.3253 0.5815 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
  14308. 1.0589 -0.6914 -0.2707 C 0 0 0 0 0 0 0 0 0 0 0 0
  14309. -0.5180 -2.0689 -0.7774 H 0 0 0 0 0 0 0 0 0 0 0 0
  14310. -2.3238 -0.4572 -0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0
  14311. -1.6631 1.7981 0.6944 H 0 0 0 0 0 0 0 0 0 0 0 0
  14312. 2.3464 0.9307 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0
  14313. 1.8678 -1.3641 -0.5321 H 0 0 0 0 0 0 0 0 0 0 0 0
  14314. 1 2 2 0
  14315. 2 3 1 0
  14316. 3 4 2 0
  14317. 4 5 1 0
  14318. 5 6 2 0
  14319. 6 1 1 0
  14320. 1 7 1 0
  14321. 2 8 1 0
  14322. 3 9 1 0
  14323. 5 10 1 0
  14324. 6 11 1 0
  14325. M END
  14326. $$$$
  14327. RDKit 3D
  14328. 11 11 0 0 0 0 0 0 0 0999 V2000
  14329. -0.2702 -1.0764 -0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0
  14330. -1.2785 -0.1854 -0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
  14331. -0.9129 1.0631 0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0
  14332. 0.3682 1.4668 0.5617 N 0 0 0 0 0 0 0 0 0 0 0 0
  14333. 1.3253 0.5801 0.2117 C 0 0 0 0 0 0 0 0 0 0 0 0
  14334. 1.0589 -0.6897 -0.2751 C 0 0 0 0 0 0 0 0 0 0 0 0
  14335. -0.5180 -2.0639 -0.7904 H 0 0 0 0 0 0 0 0 0 0 0 0
  14336. -2.3238 -0.4563 -0.1551 H 0 0 0 0 0 0 0 0 0 0 0 0
  14337. -1.6631 1.7937 0.7057 H 0 0 0 0 0 0 0 0 0 0 0 0
  14338. 2.3464 0.9286 0.3368 H 0 0 0 0 0 0 0 0 0 0 0 0
  14339. 1.8678 -1.3607 -0.5407 H 0 0 0 0 0 0 0 0 0 0 0 0
  14340. 1 2 2 0
  14341. 2 3 1 0
  14342. 3 4 2 0
  14343. 4 5 1 0
  14344. 5 6 2 0
  14345. 6 1 1 0
  14346. 1 7 1 0
  14347. 2 8 1 0
  14348. 3 9 1 0
  14349. 5 10 1 0
  14350. 6 11 1 0
  14351. M END
  14352. $$$$
  14353. RDKit 3D
  14354. 11 11 0 0 0 0 0 0 0 0999 V2000
  14355. -0.2702 -1.0738 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0
  14356. -1.2785 -0.1850 -0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0
  14357. -0.9129 1.0604 0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0
  14358. 0.3682 1.4633 0.5709 N 0 0 0 0 0 0 0 0 0 0 0 0
  14359. 1.3253 0.5788 0.2153 C 0 0 0 0 0 0 0 0 0 0 0 0
  14360. 1.0589 -0.6880 -0.2794 C 0 0 0 0 0 0 0 0 0 0 0 0
  14361. -0.5180 -2.0589 -0.8033 H 0 0 0 0 0 0 0 0 0 0 0 0
  14362. -2.3238 -0.4553 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0
  14363. -1.6631 1.7893 0.7169 H 0 0 0 0 0 0 0 0 0 0 0 0
  14364. 2.3464 0.9264 0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0
  14365. 1.8678 -1.3573 -0.5492 H 0 0 0 0 0 0 0 0 0 0 0 0
  14366. 1 2 2 0
  14367. 2 3 1 0
  14368. 3 4 2 0
  14369. 4 5 1 0
  14370. 5 6 2 0
  14371. 6 1 1 0
  14372. 1 7 1 0
  14373. 2 8 1 0
  14374. 3 9 1 0
  14375. 5 10 1 0
  14376. 6 11 1 0
  14377. M END
  14378. $$$$
  14379. RDKit 3D
  14380. 11 11 0 0 0 0 0 0 0 0999 V2000
  14381. -0.2702 -1.0711 -0.4257 C 0 0 0 0 0 0 0 0 0 0 0 0
  14382. -1.2785 -0.1846 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0
  14383. -0.9129 1.0578 0.4309 C 0 0 0 0 0 0 0 0 0 0 0 0
  14384. 0.3682 1.4597 0.5801 N 0 0 0 0 0 0 0 0 0 0 0 0
  14385. 1.3253 0.5774 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0
  14386. 1.0589 -0.6862 -0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0
  14387. -0.5180 -2.0538 -0.8163 H 0 0 0 0 0 0 0 0 0 0 0 0
  14388. -2.3238 -0.4543 -0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0
  14389. -1.6631 1.7847 0.7281 H 0 0 0 0 0 0 0 0 0 0 0 0
  14390. 2.3464 0.9243 0.3485 H 0 0 0 0 0 0 0 0 0 0 0 0
  14391. 1.8678 -1.3538 -0.5577 H 0 0 0 0 0 0 0 0 0 0 0 0
  14392. 1 2 2 0
  14393. 2 3 1 0
  14394. 3 4 2 0
  14395. 4 5 1 0
  14396. 5 6 2 0
  14397. 6 1 1 0
  14398. 1 7 1 0
  14399. 2 8 1 0
  14400. 3 9 1 0
  14401. 5 10 1 0
  14402. 6 11 1 0
  14403. M END
  14404. $$$$
  14405. RDKit 3D
  14406. 11 11 0 0 0 0 0 0 0 0999 V2000
  14407. -0.2702 -1.0685 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0
  14408. -1.2785 -0.1842 -0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0
  14409. -0.9129 1.0550 0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0
  14410. 0.3682 1.4560 0.5893 N 0 0 0 0 0 0 0 0 0 0 0 0
  14411. 1.3253 0.5760 0.2226 C 0 0 0 0 0 0 0 0 0 0 0 0
  14412. 1.0589 -0.6844 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  14413. -0.5180 -2.0487 -0.8291 H 0 0 0 0 0 0 0 0 0 0 0 0
  14414. -2.3238 -0.4532 -0.1637 H 0 0 0 0 0 0 0 0 0 0 0 0
  14415. -1.6631 1.7801 0.7393 H 0 0 0 0 0 0 0 0 0 0 0 0
  14416. 2.3464 0.9221 0.3543 H 0 0 0 0 0 0 0 0 0 0 0 0
  14417. 1.8678 -1.3502 -0.5662 H 0 0 0 0 0 0 0 0 0 0 0 0
  14418. 1 2 2 0
  14419. 2 3 1 0
  14420. 3 4 2 0
  14421. 4 5 1 0
  14422. 5 6 2 0
  14423. 6 1 1 0
  14424. 1 7 1 0
  14425. 2 8 1 0
  14426. 3 9 1 0
  14427. 5 10 1 0
  14428. 6 11 1 0
  14429. M END
  14430. $$$$
  14431. RDKit 3D
  14432. 11 11 0 0 0 0 0 0 0 0999 V2000
  14433. -0.2702 -1.0657 -0.4391 C 0 0 0 0 0 0 0 0 0 0 0 0
  14434. -1.2785 -0.1838 -0.0647 C 0 0 0 0 0 0 0 0 0 0 0 0
  14435. -0.9129 1.0523 0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0
  14436. 0.3682 1.4523 0.5984 N 0 0 0 0 0 0 0 0 0 0 0 0
  14437. 1.3253 0.5746 0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0
  14438. 1.0589 -0.6826 -0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0
  14439. -0.5180 -2.0434 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0
  14440. -2.3238 -0.4522 -0.1665 H 0 0 0 0 0 0 0 0 0 0 0 0
  14441. -1.6631 1.7754 0.7505 H 0 0 0 0 0 0 0 0 0 0 0 0
  14442. 2.3464 0.9198 0.3601 H 0 0 0 0 0 0 0 0 0 0 0 0
  14443. 1.8678 -1.3467 -0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0
  14444. 1 2 2 0
  14445. 2 3 1 0
  14446. 3 4 2 0
  14447. 4 5 1 0
  14448. 5 6 2 0
  14449. 6 1 1 0
  14450. 1 7 1 0
  14451. 2 8 1 0
  14452. 3 9 1 0
  14453. 5 10 1 0
  14454. 6 11 1 0
  14455. M END
  14456. $$$$
  14457. RDKit 3D
  14458. 11 11 0 0 0 0 0 0 0 0999 V2000
  14459. -0.2702 -1.0629 -0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0
  14460. -1.2785 -0.1834 -0.0658 C 0 0 0 0 0 0 0 0 0 0 0 0
  14461. -0.9129 1.0494 0.4508 C 0 0 0 0 0 0 0 0 0 0 0 0
  14462. 0.3682 1.4485 0.6075 N 0 0 0 0 0 0 0 0 0 0 0 0
  14463. 1.3253 0.5732 0.2298 C 0 0 0 0 0 0 0 0 0 0 0 0
  14464. 1.0589 -0.6807 -0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0
  14465. -0.5180 -2.0381 -0.8548 H 0 0 0 0 0 0 0 0 0 0 0 0
  14466. -2.3238 -0.4512 -0.1694 H 0 0 0 0 0 0 0 0 0 0 0 0
  14467. -1.6631 1.7707 0.7617 H 0 0 0 0 0 0 0 0 0 0 0 0
  14468. 2.3464 0.9175 0.3658 H 0 0 0 0 0 0 0 0 0 0 0 0
  14469. 1.8678 -1.3430 -0.5831 H 0 0 0 0 0 0 0 0 0 0 0 0
  14470. 1 2 2 0
  14471. 2 3 1 0
  14472. 3 4 2 0
  14473. 4 5 1 0
  14474. 5 6 2 0
  14475. 6 1 1 0
  14476. 1 7 1 0
  14477. 2 8 1 0
  14478. 3 9 1 0
  14479. 5 10 1 0
  14480. 6 11 1 0
  14481. M END
  14482. $$$$
  14483. RDKit 3D
  14484. 11 11 0 0 0 0 0 0 0 0999 V2000
  14485. -0.2702 -1.0601 -0.4525 C 0 0 0 0 0 0 0 0 0 0 0 0
  14486. -1.2785 -0.1830 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0
  14487. -0.9129 1.0466 0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0
  14488. 0.3682 1.4446 0.6166 N 0 0 0 0 0 0 0 0 0 0 0 0
  14489. 1.3253 0.5718 0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0
  14490. 1.0589 -0.6789 -0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0
  14491. -0.5180 -2.0327 -0.8676 H 0 0 0 0 0 0 0 0 0 0 0 0
  14492. -2.3238 -0.4501 -0.1722 H 0 0 0 0 0 0 0 0 0 0 0 0
  14493. -1.6631 1.7659 0.7728 H 0 0 0 0 0 0 0 0 0 0 0 0
  14494. 2.3464 0.9152 0.3716 H 0 0 0 0 0 0 0 0 0 0 0 0
  14495. 1.8678 -1.3393 -0.5916 H 0 0 0 0 0 0 0 0 0 0 0 0
  14496. 1 2 2 0
  14497. 2 3 1 0
  14498. 3 4 2 0
  14499. 4 5 1 0
  14500. 5 6 2 0
  14501. 6 1 1 0
  14502. 1 7 1 0
  14503. 2 8 1 0
  14504. 3 9 1 0
  14505. 5 10 1 0
  14506. 6 11 1 0
  14507. M END
  14508. $$$$
  14509. RDKit 3D
  14510. 11 11 0 0 0 0 0 0 0 0999 V2000
  14511. -0.2702 -1.0572 -0.4591 C 0 0 0 0 0 0 0 0 0 0 0 0
  14512. -1.2785 -0.1825 -0.0681 C 0 0 0 0 0 0 0 0 0 0 0 0
  14513. -0.9129 1.0437 0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0
  14514. 0.3682 1.4407 0.6257 N 0 0 0 0 0 0 0 0 0 0 0 0
  14515. 1.3253 0.5703 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
  14516. 1.0589 -0.6770 -0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0
  14517. -0.5180 -2.0272 -0.8804 H 0 0 0 0 0 0 0 0 0 0 0 0
  14518. -2.3238 -0.4490 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0
  14519. -1.6631 1.7610 0.7838 H 0 0 0 0 0 0 0 0 0 0 0 0
  14520. 2.3464 0.9129 0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0
  14521. 1.8678 -1.3356 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0
  14522. 1 2 2 0
  14523. 2 3 1 0
  14524. 3 4 2 0
  14525. 4 5 1 0
  14526. 5 6 2 0
  14527. 6 1 1 0
  14528. 1 7 1 0
  14529. 2 8 1 0
  14530. 3 9 1 0
  14531. 5 10 1 0
  14532. 6 11 1 0
  14533. M END
  14534. $$$$
  14535. RDKit 3D
  14536. 11 11 0 0 0 0 0 0 0 0999 V2000
  14537. -0.2702 -1.0543 -0.4658 C 0 0 0 0 0 0 0 0 0 0 0 0
  14538. -1.2785 -0.1821 -0.0693 C 0 0 0 0 0 0 0 0 0 0 0 0
  14539. -0.9129 1.0408 0.4705 C 0 0 0 0 0 0 0 0 0 0 0 0
  14540. 0.3682 1.4368 0.6347 N 0 0 0 0 0 0 0 0 0 0 0 0
  14541. 1.3253 0.5688 0.2406 C 0 0 0 0 0 0 0 0 0 0 0 0
  14542. 1.0589 -0.6750 -0.3094 C 0 0 0 0 0 0 0 0 0 0 0 0
  14543. -0.5180 -2.0216 -0.8931 H 0 0 0 0 0 0 0 0 0 0 0 0
  14544. -2.3238 -0.4479 -0.1778 H 0 0 0 0 0 0 0 0 0 0 0 0
  14545. -1.6631 1.7560 0.7949 H 0 0 0 0 0 0 0 0 0 0 0 0
  14546. 2.3464 0.9105 0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0
  14547. 1.8678 -1.3318 -0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0
  14548. 1 2 2 0
  14549. 2 3 1 0
  14550. 3 4 2 0
  14551. 4 5 1 0
  14552. 5 6 2 0
  14553. 6 1 1 0
  14554. 1 7 1 0
  14555. 2 8 1 0
  14556. 3 9 1 0
  14557. 5 10 1 0
  14558. 6 11 1 0
  14559. M END
  14560. $$$$
  14561. RDKit 3D
  14562. 11 11 0 0 0 0 0 0 0 0999 V2000
  14563. -0.2702 -1.0514 -0.4724 C 0 0 0 0 0 0 0 0 0 0 0 0
  14564. -1.2785 -0.1817 -0.0704 C 0 0 0 0 0 0 0 0 0 0 0 0
  14565. -0.9129 1.0378 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0
  14566. 0.3682 1.4328 0.6437 N 0 0 0 0 0 0 0 0 0 0 0 0
  14567. 1.3253 0.5673 0.2441 C 0 0 0 0 0 0 0 0 0 0 0 0
  14568. 1.0589 -0.6731 -0.3136 C 0 0 0 0 0 0 0 0 0 0 0 0
  14569. -0.5180 -2.0160 -0.9058 H 0 0 0 0 0 0 0 0 0 0 0 0
  14570. -2.3238 -0.4468 -0.1807 H 0 0 0 0 0 0 0 0 0 0 0 0
  14571. -1.6631 1.7510 0.8059 H 0 0 0 0 0 0 0 0 0 0 0 0
  14572. 2.3464 0.9081 0.3888 H 0 0 0 0 0 0 0 0 0 0 0 0
  14573. 1.8678 -1.3279 -0.6167 H 0 0 0 0 0 0 0 0 0 0 0 0
  14574. 1 2 2 0
  14575. 2 3 1 0
  14576. 3 4 2 0
  14577. 4 5 1 0
  14578. 5 6 2 0
  14579. 6 1 1 0
  14580. 1 7 1 0
  14581. 2 8 1 0
  14582. 3 9 1 0
  14583. 5 10 1 0
  14584. 6 11 1 0
  14585. M END
  14586. $$$$
  14587. RDKit 3D
  14588. 11 11 0 0 0 0 0 0 0 0999 V2000
  14589. -0.2702 -1.0484 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0
  14590. -1.2785 -0.1812 -0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0
  14591. -0.9129 1.0348 0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0
  14592. 0.3682 1.4287 0.6527 N 0 0 0 0 0 0 0 0 0 0 0 0
  14593. 1.3253 0.5657 0.2477 C 0 0 0 0 0 0 0 0 0 0 0 0
  14594. 1.0589 -0.6711 -0.3178 C 0 0 0 0 0 0 0 0 0 0 0 0
  14595. -0.5180 -2.0102 -0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0
  14596. -2.3238 -0.4456 -0.1835 H 0 0 0 0 0 0 0 0 0 0 0 0
  14597. -1.6631 1.7459 0.8169 H 0 0 0 0 0 0 0 0 0 0 0 0
  14598. 2.3464 0.9056 0.3945 H 0 0 0 0 0 0 0 0 0 0 0 0
  14599. 1.8678 -1.3240 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0
  14600. 1 2 2 0
  14601. 2 3 1 0
  14602. 3 4 2 0
  14603. 4 5 1 0
  14604. 5 6 2 0
  14605. 6 1 1 0
  14606. 1 7 1 0
  14607. 2 8 1 0
  14608. 3 9 1 0
  14609. 5 10 1 0
  14610. 6 11 1 0
  14611. M END
  14612. $$$$
  14613. RDKit 3D
  14614. 11 11 0 0 0 0 0 0 0 0999 V2000
  14615. -0.2702 -1.0454 -0.4856 C 0 0 0 0 0 0 0 0 0 0 0 0
  14616. -1.2785 -0.1808 -0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0
  14617. -0.9129 1.0317 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0
  14618. 0.3682 1.4246 0.6617 N 0 0 0 0 0 0 0 0 0 0 0 0
  14619. 1.3253 0.5641 0.2513 C 0 0 0 0 0 0 0 0 0 0 0 0
  14620. 1.0589 -0.6691 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0
  14621. -0.5180 -2.0044 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0
  14622. -2.3238 -0.4445 -0.1863 H 0 0 0 0 0 0 0 0 0 0 0 0
  14623. -1.6631 1.7407 0.8279 H 0 0 0 0 0 0 0 0 0 0 0 0
  14624. 2.3464 0.9031 0.4002 H 0 0 0 0 0 0 0 0 0 0 0 0
  14625. 1.8678 -1.3201 -0.6334 H 0 0 0 0 0 0 0 0 0 0 0 0
  14626. 1 2 2 0
  14627. 2 3 1 0
  14628. 3 4 2 0
  14629. 4 5 1 0
  14630. 5 6 2 0
  14631. 6 1 1 0
  14632. 1 7 1 0
  14633. 2 8 1 0
  14634. 3 9 1 0
  14635. 5 10 1 0
  14636. 6 11 1 0
  14637. M END
  14638. $$$$
  14639. RDKit 3D
  14640. 11 11 0 0 0 0 0 0 0 0999 V2000
  14641. -0.2702 -1.0423 -0.4921 C 0 0 0 0 0 0 0 0 0 0 0 0
  14642. -1.2785 -0.1803 -0.0738 C 0 0 0 0 0 0 0 0 0 0 0 0
  14643. -0.9129 1.0286 0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0
  14644. 0.3682 1.4204 0.6706 N 0 0 0 0 0 0 0 0 0 0 0 0
  14645. 1.3253 0.5625 0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0
  14646. 1.0589 -0.6670 -0.3262 C 0 0 0 0 0 0 0 0 0 0 0 0
  14647. -0.5180 -1.9985 -0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0
  14648. -2.3238 -0.4433 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0
  14649. -1.6631 1.7355 0.8388 H 0 0 0 0 0 0 0 0 0 0 0 0
  14650. 2.3464 0.9006 0.4058 H 0 0 0 0 0 0 0 0 0 0 0 0
  14651. 1.8678 -1.3161 -0.6416 H 0 0 0 0 0 0 0 0 0 0 0 0
  14652. 1 2 2 0
  14653. 2 3 1 0
  14654. 3 4 2 0
  14655. 4 5 1 0
  14656. 5 6 2 0
  14657. 6 1 1 0
  14658. 1 7 1 0
  14659. 2 8 1 0
  14660. 3 9 1 0
  14661. 5 10 1 0
  14662. 6 11 1 0
  14663. M END
  14664. $$$$
  14665. RDKit 3D
  14666. 11 11 0 0 0 0 0 0 0 0999 V2000
  14667. -0.2702 -1.0392 -0.4987 C 0 0 0 0 0 0 0 0 0 0 0 0
  14668. -1.2785 -0.1798 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  14669. -0.9129 1.0255 0.5029 C 0 0 0 0 0 0 0 0 0 0 0 0
  14670. 0.3682 1.4161 0.6795 N 0 0 0 0 0 0 0 0 0 0 0 0
  14671. 1.3253 0.5609 0.2583 C 0 0 0 0 0 0 0 0 0 0 0 0
  14672. 1.0589 -0.6650 -0.3304 C 0 0 0 0 0 0 0 0 0 0 0 0
  14673. -0.5180 -1.9926 -0.9561 H 0 0 0 0 0 0 0 0 0 0 0 0
  14674. -2.3238 -0.4421 -0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0
  14675. -1.6631 1.7302 0.8497 H 0 0 0 0 0 0 0 0 0 0 0 0
  14676. 2.3464 0.8980 0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0
  14677. 1.8678 -1.3120 -0.6499 H 0 0 0 0 0 0 0 0 0 0 0 0
  14678. 1 2 2 0
  14679. 2 3 1 0
  14680. 3 4 2 0
  14681. 4 5 1 0
  14682. 5 6 2 0
  14683. 6 1 1 0
  14684. 1 7 1 0
  14685. 2 8 1 0
  14686. 3 9 1 0
  14687. 5 10 1 0
  14688. 6 11 1 0
  14689. M END
  14690. $$$$
  14691. RDKit 3D
  14692. 11 11 0 0 0 0 0 0 0 0999 V2000
  14693. -0.2702 -1.0360 -0.5052 C 0 0 0 0 0 0 0 0 0 0 0 0
  14694. -1.2785 -0.1794 -0.0761 C 0 0 0 0 0 0 0 0 0 0 0 0
  14695. -0.9129 1.0223 0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0
  14696. 0.3682 1.4118 0.6884 N 0 0 0 0 0 0 0 0 0 0 0 0
  14697. 1.3253 0.5593 0.2618 C 0 0 0 0 0 0 0 0 0 0 0 0
  14698. 1.0589 -0.6629 -0.3346 C 0 0 0 0 0 0 0 0 0 0 0 0
  14699. -0.5180 -1.9865 -0.9686 H 0 0 0 0 0 0 0 0 0 0 0 0
  14700. -2.3238 -0.4409 -0.1946 H 0 0 0 0 0 0 0 0 0 0 0 0
  14701. -1.6631 1.7248 0.8605 H 0 0 0 0 0 0 0 0 0 0 0 0
  14702. 2.3464 0.8954 0.4171 H 0 0 0 0 0 0 0 0 0 0 0 0
  14703. 1.8678 -1.3079 -0.6581 H 0 0 0 0 0 0 0 0 0 0 0 0
  14704. 1 2 2 0
  14705. 2 3 1 0
  14706. 3 4 2 0
  14707. 4 5 1 0
  14708. 5 6 2 0
  14709. 6 1 1 0
  14710. 1 7 1 0
  14711. 2 8 1 0
  14712. 3 9 1 0
  14713. 5 10 1 0
  14714. 6 11 1 0
  14715. M END
  14716. $$$$
  14717. RDKit 3D
  14718. 11 11 0 0 0 0 0 0 0 0999 V2000
  14719. -0.2702 -1.0328 -0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0
  14720. -1.2785 -0.1789 -0.0772 C 0 0 0 0 0 0 0 0 0 0 0 0
  14721. -0.9129 1.0191 0.5158 C 0 0 0 0 0 0 0 0 0 0 0 0
  14722. 0.3682 1.4075 0.6973 N 0 0 0 0 0 0 0 0 0 0 0 0
  14723. 1.3253 0.5576 0.2654 C 0 0 0 0 0 0 0 0 0 0 0 0
  14724. 1.0589 -0.6608 -0.3387 C 0 0 0 0 0 0 0 0 0 0 0 0
  14725. -0.5180 -1.9804 -0.9811 H 0 0 0 0 0 0 0 0 0 0 0 0
  14726. -2.3238 -0.4396 -0.1974 H 0 0 0 0 0 0 0 0 0 0 0 0
  14727. -1.6631 1.7194 0.8713 H 0 0 0 0 0 0 0 0 0 0 0 0
  14728. 2.3464 0.8928 0.4227 H 0 0 0 0 0 0 0 0 0 0 0 0
  14729. 1.8678 -1.3038 -0.6663 H 0 0 0 0 0 0 0 0 0 0 0 0
  14730. 1 2 2 0
  14731. 2 3 1 0
  14732. 3 4 2 0
  14733. 4 5 1 0
  14734. 5 6 2 0
  14735. 6 1 1 0
  14736. 1 7 1 0
  14737. 2 8 1 0
  14738. 3 9 1 0
  14739. 5 10 1 0
  14740. 6 11 1 0
  14741. M END
  14742. $$$$
  14743. RDKit 3D
  14744. 11 11 0 0 0 0 0 0 0 0999 V2000
  14745. -0.2702 -1.0296 -0.5182 C 0 0 0 0 0 0 0 0 0 0 0 0
  14746. -1.2785 -0.1784 -0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
  14747. -0.9129 1.0158 0.5222 C 0 0 0 0 0 0 0 0 0 0 0 0
  14748. 0.3682 1.4031 0.7061 N 0 0 0 0 0 0 0 0 0 0 0 0
  14749. 1.3253 0.5560 0.2688 C 0 0 0 0 0 0 0 0 0 0 0 0
  14750. 1.0589 -0.6586 -0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0
  14751. -0.5180 -1.9742 -0.9935 H 0 0 0 0 0 0 0 0 0 0 0 0
  14752. -2.3238 -0.4384 -0.2001 H 0 0 0 0 0 0 0 0 0 0 0 0
  14753. -1.6631 1.7138 0.8821 H 0 0 0 0 0 0 0 0 0 0 0 0
  14754. 2.3464 0.8901 0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0
  14755. 1.8678 -1.2995 -0.6745 H 0 0 0 0 0 0 0 0 0 0 0 0
  14756. 1 2 2 0
  14757. 2 3 1 0
  14758. 3 4 2 0
  14759. 4 5 1 0
  14760. 5 6 2 0
  14761. 6 1 1 0
  14762. 1 7 1 0
  14763. 2 8 1 0
  14764. 3 9 1 0
  14765. 5 10 1 0
  14766. 6 11 1 0
  14767. M END
  14768. $$$$
  14769. RDKit 3D
  14770. 11 11 0 0 0 0 0 0 0 0999 V2000
  14771. -0.2702 -1.0263 -0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0
  14772. -1.2785 -0.1779 -0.0795 C 0 0 0 0 0 0 0 0 0 0 0 0
  14773. -0.9129 1.0125 0.5285 C 0 0 0 0 0 0 0 0 0 0 0 0
  14774. 0.3682 1.3986 0.7149 N 0 0 0 0 0 0 0 0 0 0 0 0
  14775. 1.3253 0.5543 0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0
  14776. 1.0589 -0.6565 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0
  14777. -0.5180 -1.9679 -1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0
  14778. -2.3238 -0.4371 -0.2029 H 0 0 0 0 0 0 0 0 0 0 0 0
  14779. -1.6631 1.7083 0.8929 H 0 0 0 0 0 0 0 0 0 0 0 0
  14780. 2.3464 0.8874 0.4339 H 0 0 0 0 0 0 0 0 0 0 0 0
  14781. 1.8678 -1.2953 -0.6827 H 0 0 0 0 0 0 0 0 0 0 0 0
  14782. 1 2 2 0
  14783. 2 3 1 0
  14784. 3 4 2 0
  14785. 4 5 1 0
  14786. 5 6 2 0
  14787. 6 1 1 0
  14788. 1 7 1 0
  14789. 2 8 1 0
  14790. 3 9 1 0
  14791. 5 10 1 0
  14792. 6 11 1 0
  14793. M END
  14794. $$$$
  14795. RDKit 3D
  14796. 11 11 0 0 0 0 0 0 0 0999 V2000
  14797. -0.2702 -1.0230 -0.5311 C 0 0 0 0 0 0 0 0 0 0 0 0
  14798. -1.2785 -0.1774 -0.0806 C 0 0 0 0 0 0 0 0 0 0 0 0
  14799. -0.9129 1.0092 0.5349 C 0 0 0 0 0 0 0 0 0 0 0 0
  14800. 0.3682 1.3941 0.7237 N 0 0 0 0 0 0 0 0 0 0 0 0
  14801. 1.3253 0.5525 0.2758 C 0 0 0 0 0 0 0 0 0 0 0 0
  14802. 1.0589 -0.6543 -0.3511 C 0 0 0 0 0 0 0 0 0 0 0 0
  14803. -0.5180 -1.9616 -1.0183 H 0 0 0 0 0 0 0 0 0 0 0 0
  14804. -2.3238 -0.4358 -0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0
  14805. -1.6631 1.7026 0.9036 H 0 0 0 0 0 0 0 0 0 0 0 0
  14806. 2.3464 0.8846 0.4395 H 0 0 0 0 0 0 0 0 0 0 0 0
  14807. 1.8678 -1.2910 -0.6908 H 0 0 0 0 0 0 0 0 0 0 0 0
  14808. 1 2 2 0
  14809. 2 3 1 0
  14810. 3 4 2 0
  14811. 4 5 1 0
  14812. 5 6 2 0
  14813. 6 1 1 0
  14814. 1 7 1 0
  14815. 2 8 1 0
  14816. 3 9 1 0
  14817. 5 10 1 0
  14818. 6 11 1 0
  14819. M END
  14820. $$$$
  14821. RDKit 3D
  14822. 11 11 0 0 0 0 0 0 0 0999 V2000
  14823. -0.2702 -1.0197 -0.5375 C 0 0 0 0 0 0 0 0 0 0 0 0
  14824. -1.2785 -0.1769 -0.0817 C 0 0 0 0 0 0 0 0 0 0 0 0
  14825. -0.9129 1.0058 0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0
  14826. 0.3682 1.3895 0.7324 N 0 0 0 0 0 0 0 0 0 0 0 0
  14827. 1.3253 0.5508 0.2793 C 0 0 0 0 0 0 0 0 0 0 0 0
  14828. 1.0589 -0.6521 -0.3552 C 0 0 0 0 0 0 0 0 0 0 0 0
  14829. -0.5180 -1.9551 -1.0306 H 0 0 0 0 0 0 0 0 0 0 0 0
  14830. -2.3238 -0.4345 -0.2084 H 0 0 0 0 0 0 0 0 0 0 0 0
  14831. -1.6631 1.6969 0.9143 H 0 0 0 0 0 0 0 0 0 0 0 0
  14832. 2.3464 0.8819 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  14833. 1.8678 -1.2866 -0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
  14834. 1 2 2 0
  14835. 2 3 1 0
  14836. 3 4 2 0
  14837. 4 5 1 0
  14838. 5 6 2 0
  14839. 6 1 1 0
  14840. 1 7 1 0
  14841. 2 8 1 0
  14842. 3 9 1 0
  14843. 5 10 1 0
  14844. 6 11 1 0
  14845. M END
  14846. $$$$
  14847. RDKit 3D
  14848. 11 11 0 0 0 0 0 0 0 0999 V2000
  14849. -0.2702 -1.0163 -0.5439 C 0 0 0 0 0 0 0 0 0 0 0 0
  14850. -1.2785 -0.1764 -0.0828 C 0 0 0 0 0 0 0 0 0 0 0 0
  14851. -0.9129 1.0024 0.5475 C 0 0 0 0 0 0 0 0 0 0 0 0
  14852. 0.3682 1.3849 0.7411 N 0 0 0 0 0 0 0 0 0 0 0 0
  14853. 1.3253 0.5490 0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0
  14854. 1.0589 -0.6498 -0.3593 C 0 0 0 0 0 0 0 0 0 0 0 0
  14855. -0.5180 -1.9486 -1.0428 H 0 0 0 0 0 0 0 0 0 0 0 0
  14856. -2.3238 -0.4332 -0.2111 H 0 0 0 0 0 0 0 0 0 0 0 0
  14857. -1.6631 1.6911 0.9249 H 0 0 0 0 0 0 0 0 0 0 0 0
  14858. 2.3464 0.8790 0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0
  14859. 1.8678 -1.2822 -0.7069 H 0 0 0 0 0 0 0 0 0 0 0 0
  14860. 1 2 2 0
  14861. 2 3 1 0
  14862. 3 4 2 0
  14863. 4 5 1 0
  14864. 5 6 2 0
  14865. 6 1 1 0
  14866. 1 7 1 0
  14867. 2 8 1 0
  14868. 3 9 1 0
  14869. 5 10 1 0
  14870. 6 11 1 0
  14871. M END
  14872. $$$$
  14873. RDKit 3D
  14874. 11 11 0 0 0 0 0 0 0 0999 V2000
  14875. -0.2702 -1.0128 -0.5502 C 0 0 0 0 0 0 0 0 0 0 0 0
  14876. -1.2785 -0.1759 -0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0
  14877. -0.9129 0.9989 0.5538 C 0 0 0 0 0 0 0 0 0 0 0 0
  14878. 0.3682 1.3802 0.7498 N 0 0 0 0 0 0 0 0 0 0 0 0
  14879. 1.3253 0.5472 0.2862 C 0 0 0 0 0 0 0 0 0 0 0 0
  14880. 1.0589 -0.6475 -0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0
  14881. -0.5180 -1.9420 -1.0551 H 0 0 0 0 0 0 0 0 0 0 0 0
  14882. -2.3238 -0.4319 -0.2138 H 0 0 0 0 0 0 0 0 0 0 0 0
  14883. -1.6631 1.6853 0.9355 H 0 0 0 0 0 0 0 0 0 0 0 0
  14884. 2.3464 0.8762 0.4561 H 0 0 0 0 0 0 0 0 0 0 0 0
  14885. 1.8678 -1.2777 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0
  14886. 1 2 2 0
  14887. 2 3 1 0
  14888. 3 4 2 0
  14889. 4 5 1 0
  14890. 5 6 2 0
  14891. 6 1 1 0
  14892. 1 7 1 0
  14893. 2 8 1 0
  14894. 3 9 1 0
  14895. 5 10 1 0
  14896. 6 11 1 0
  14897. M END
  14898. $$$$
  14899. RDKit 3D
  14900. 11 11 0 0 0 0 0 0 0 0999 V2000
  14901. -0.2702 -1.0093 -0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0
  14902. -1.2785 -0.1753 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  14903. -0.9129 0.9954 0.5601 C 0 0 0 0 0 0 0 0 0 0 0 0
  14904. 0.3682 1.3755 0.7585 N 0 0 0 0 0 0 0 0 0 0 0 0
  14905. 1.3253 0.5454 0.2896 C 0 0 0 0 0 0 0 0 0 0 0 0
  14906. 1.0589 -0.6452 -0.3675 C 0 0 0 0 0 0 0 0 0 0 0 0
  14907. -0.5180 -1.9353 -1.0672 H 0 0 0 0 0 0 0 0 0 0 0 0
  14908. -2.3238 -0.4305 -0.2165 H 0 0 0 0 0 0 0 0 0 0 0 0
  14909. -1.6631 1.6794 0.9461 H 0 0 0 0 0 0 0 0 0 0 0 0
  14910. 2.3464 0.8733 0.4616 H 0 0 0 0 0 0 0 0 0 0 0 0
  14911. 1.8678 -1.2732 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0
  14912. 1 2 2 0
  14913. 2 3 1 0
  14914. 3 4 2 0
  14915. 4 5 1 0
  14916. 5 6 2 0
  14917. 6 1 1 0
  14918. 1 7 1 0
  14919. 2 8 1 0
  14920. 3 9 1 0
  14921. 5 10 1 0
  14922. 6 11 1 0
  14923. M END
  14924. $$$$
  14925. RDKit 3D
  14926. 11 11 0 0 0 0 0 0 0 0999 V2000
  14927. -0.2702 -1.0058 -0.5629 C 0 0 0 0 0 0 0 0 0 0 0 0
  14928. -1.2785 -0.1748 -0.0861 C 0 0 0 0 0 0 0 0 0 0 0 0
  14929. -0.9129 0.9919 0.5663 C 0 0 0 0 0 0 0 0 0 0 0 0
  14930. 0.3682 1.3707 0.7671 N 0 0 0 0 0 0 0 0 0 0 0 0
  14931. 1.3253 0.5436 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0
  14932. 1.0589 -0.6429 -0.3715 C 0 0 0 0 0 0 0 0 0 0 0 0
  14933. -0.5180 -1.9286 -1.0794 H 0 0 0 0 0 0 0 0 0 0 0 0
  14934. -2.3238 -0.4292 -0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0
  14935. -1.6631 1.6734 0.9566 H 0 0 0 0 0 0 0 0 0 0 0 0
  14936. 2.3464 0.8704 0.4671 H 0 0 0 0 0 0 0 0 0 0 0 0
  14937. 1.8678 -1.2686 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0
  14938. 1 2 2 0
  14939. 2 3 1 0
  14940. 3 4 2 0
  14941. 4 5 1 0
  14942. 5 6 2 0
  14943. 6 1 1 0
  14944. 1 7 1 0
  14945. 2 8 1 0
  14946. 3 9 1 0
  14947. 5 10 1 0
  14948. 6 11 1 0
  14949. M END
  14950. $$$$
  14951. RDKit 3D
  14952. 11 11 0 0 0 0 0 0 0 0999 V2000
  14953. -0.2702 -1.0023 -0.5692 C 0 0 0 0 0 0 0 0 0 0 0 0
  14954. -1.2785 -0.1742 -0.0872 C 0 0 0 0 0 0 0 0 0 0 0 0
  14955. -0.9129 0.9883 0.5725 C 0 0 0 0 0 0 0 0 0 0 0 0
  14956. 0.3682 1.3658 0.7757 N 0 0 0 0 0 0 0 0 0 0 0 0
  14957. 1.3253 0.5418 0.2964 C 0 0 0 0 0 0 0 0 0 0 0 0
  14958. 1.0589 -0.6406 -0.3756 C 0 0 0 0 0 0 0 0 0 0 0 0
  14959. -0.5180 -1.9218 -1.0915 H 0 0 0 0 0 0 0 0 0 0 0 0
  14960. -2.3238 -0.4278 -0.2219 H 0 0 0 0 0 0 0 0 0 0 0 0
  14961. -1.6631 1.6674 0.9671 H 0 0 0 0 0 0 0 0 0 0 0 0
  14962. 2.3464 0.8674 0.4725 H 0 0 0 0 0 0 0 0 0 0 0 0
  14963. 1.8678 -1.2640 -0.7389 H 0 0 0 0 0 0 0 0 0 0 0 0
  14964. 1 2 2 0
  14965. 2 3 1 0
  14966. 3 4 2 0
  14967. 4 5 1 0
  14968. 5 6 2 0
  14969. 6 1 1 0
  14970. 1 7 1 0
  14971. 2 8 1 0
  14972. 3 9 1 0
  14973. 5 10 1 0
  14974. 6 11 1 0
  14975. M END
  14976. $$$$
  14977. RDKit 3D
  14978. 11 11 0 0 0 0 0 0 0 0999 V2000
  14979. -0.2702 -0.9987 -0.5755 C 0 0 0 0 0 0 0 0 0 0 0 0
  14980. -1.2785 -0.1737 -0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0
  14981. -0.9129 0.9847 0.5787 C 0 0 0 0 0 0 0 0 0 0 0 0
  14982. 0.3682 1.3609 0.7843 N 0 0 0 0 0 0 0 0 0 0 0 0
  14983. 1.3253 0.5399 0.2998 C 0 0 0 0 0 0 0 0 0 0 0 0
  14984. 1.0589 -0.6382 -0.3796 C 0 0 0 0 0 0 0 0 0 0 0 0
  14985. -0.5180 -1.9149 -1.1035 H 0 0 0 0 0 0 0 0 0 0 0 0
  14986. -2.3238 -0.4264 -0.2246 H 0 0 0 0 0 0 0 0 0 0 0 0
  14987. -1.6631 1.6613 0.9776 H 0 0 0 0 0 0 0 0 0 0 0 0
  14988. 2.3464 0.8645 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
  14989. 1.8678 -1.2593 -0.7469 H 0 0 0 0 0 0 0 0 0 0 0 0
  14990. 1 2 2 0
  14991. 2 3 1 0
  14992. 3 4 2 0
  14993. 4 5 1 0
  14994. 5 6 2 0
  14995. 6 1 1 0
  14996. 1 7 1 0
  14997. 2 8 1 0
  14998. 3 9 1 0
  14999. 5 10 1 0
  15000. 6 11 1 0
  15001. M END
  15002. $$$$
  15003. RDKit 3D
  15004. 11 11 0 0 0 0 0 0 0 0999 V2000
  15005. -0.2702 -0.9950 -0.5818 C 0 0 0 0 0 0 0 0 0 0 0 0
  15006. -1.2785 -0.1731 -0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0
  15007. -0.9129 0.9810 0.5849 C 0 0 0 0 0 0 0 0 0 0 0 0
  15008. 0.3682 1.3560 0.7928 N 0 0 0 0 0 0 0 0 0 0 0 0
  15009. 1.3253 0.5380 0.3032 C 0 0 0 0 0 0 0 0 0 0 0 0
  15010. 1.0589 -0.6358 -0.3836 C 0 0 0 0 0 0 0 0 0 0 0 0
  15011. -0.5180 -1.9079 -1.1155 H 0 0 0 0 0 0 0 0 0 0 0 0
  15012. -2.3238 -0.4250 -0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0
  15013. -1.6631 1.6551 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0
  15014. 2.3464 0.8614 0.4834 H 0 0 0 0 0 0 0 0 0 0 0 0
  15015. 1.8678 -1.2546 -0.7548 H 0 0 0 0 0 0 0 0 0 0 0 0
  15016. 1 2 2 0
  15017. 2 3 1 0
  15018. 3 4 2 0
  15019. 4 5 1 0
  15020. 5 6 2 0
  15021. 6 1 1 0
  15022. 1 7 1 0
  15023. 2 8 1 0
  15024. 3 9 1 0
  15025. 5 10 1 0
  15026. 6 11 1 0
  15027. M END
  15028. $$$$
  15029. RDKit 3D
  15030. 11 11 0 0 0 0 0 0 0 0999 V2000
  15031. -0.2702 -0.9914 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0
  15032. -1.2785 -0.1726 -0.0905 C 0 0 0 0 0 0 0 0 0 0 0 0
  15033. -0.9129 0.9773 0.5911 C 0 0 0 0 0 0 0 0 0 0 0 0
  15034. 0.3682 1.3510 0.8013 N 0 0 0 0 0 0 0 0 0 0 0 0
  15035. 1.3253 0.5361 0.3066 C 0 0 0 0 0 0 0 0 0 0 0 0
  15036. 1.0589 -0.6334 -0.3876 C 0 0 0 0 0 0 0 0 0 0 0 0
  15037. -0.5180 -1.9009 -1.1275 H 0 0 0 0 0 0 0 0 0 0 0 0
  15038. -2.3238 -0.4235 -0.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
  15039. -1.6631 1.6488 0.9984 H 0 0 0 0 0 0 0 0 0 0 0 0
  15040. 2.3464 0.8584 0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0
  15041. 1.8678 -1.2499 -0.7626 H 0 0 0 0 0 0 0 0 0 0 0 0
  15042. 1 2 2 0
  15043. 2 3 1 0
  15044. 3 4 2 0
  15045. 4 5 1 0
  15046. 5 6 2 0
  15047. 6 1 1 0
  15048. 1 7 1 0
  15049. 2 8 1 0
  15050. 3 9 1 0
  15051. 5 10 1 0
  15052. 6 11 1 0
  15053. M END
  15054. $$$$
  15055. RDKit 3D
  15056. 11 11 0 0 0 0 0 0 0 0999 V2000
  15057. -0.2702 -0.9876 -0.5942 C 0 0 0 0 0 0 0 0 0 0 0 0
  15058. -1.2785 -0.1720 -0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
  15059. -0.9129 0.9736 0.5972 C 0 0 0 0 0 0 0 0 0 0 0 0
  15060. 0.3682 1.3459 0.8098 N 0 0 0 0 0 0 0 0 0 0 0 0
  15061. 1.3253 0.5341 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0
  15062. 1.0589 -0.6309 -0.3915 C 0 0 0 0 0 0 0 0 0 0 0 0
  15063. -0.5180 -1.8938 -1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0
  15064. -2.3238 -0.4221 -0.2326 H 0 0 0 0 0 0 0 0 0 0 0 0
  15065. -1.6631 1.6425 1.0087 H 0 0 0 0 0 0 0 0 0 0 0 0
  15066. 2.3464 0.8553 0.4942 H 0 0 0 0 0 0 0 0 0 0 0 0
  15067. 1.8678 -1.2450 -0.7705 H 0 0 0 0 0 0 0 0 0 0 0 0
  15068. 1 2 2 0
  15069. 2 3 1 0
  15070. 3 4 2 0
  15071. 4 5 1 0
  15072. 5 6 2 0
  15073. 6 1 1 0
  15074. 1 7 1 0
  15075. 2 8 1 0
  15076. 3 9 1 0
  15077. 5 10 1 0
  15078. 6 11 1 0
  15079. M END
  15080. $$$$
  15081. RDKit 3D
  15082. 11 11 0 0 0 0 0 0 0 0999 V2000
  15083. -0.2702 -0.9839 -0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0
  15084. -1.2785 -0.1714 -0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0
  15085. -0.9129 0.9698 0.6033 C 0 0 0 0 0 0 0 0 0 0 0 0
  15086. 0.3682 1.3408 0.8182 N 0 0 0 0 0 0 0 0 0 0 0 0
  15087. 1.3253 0.5322 0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0
  15088. 1.0589 -0.6285 -0.3955 C 0 0 0 0 0 0 0 0 0 0 0 0
  15089. -0.5180 -1.8866 -1.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
  15090. -2.3238 -0.4206 -0.2352 H 0 0 0 0 0 0 0 0 0 0 0 0
  15091. -1.6631 1.6362 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0
  15092. 2.3464 0.8522 0.4995 H 0 0 0 0 0 0 0 0 0 0 0 0
  15093. 1.8678 -1.2402 -0.7783 H 0 0 0 0 0 0 0 0 0 0 0 0
  15094. 1 2 2 0
  15095. 2 3 1 0
  15096. 3 4 2 0
  15097. 4 5 1 0
  15098. 5 6 2 0
  15099. 6 1 1 0
  15100. 1 7 1 0
  15101. 2 8 1 0
  15102. 3 9 1 0
  15103. 5 10 1 0
  15104. 6 11 1 0
  15105. M END
  15106. $$$$
  15107. RDKit 3D
  15108. 11 11 0 0 0 0 0 0 0 0999 V2000
  15109. -0.2702 -0.9801 -0.6066 C 0 0 0 0 0 0 0 0 0 0 0 0
  15110. -1.2785 -0.1708 -0.0937 C 0 0 0 0 0 0 0 0 0 0 0 0
  15111. -0.9129 0.9660 0.6094 C 0 0 0 0 0 0 0 0 0 0 0 0
  15112. 0.3682 1.3356 0.8266 N 0 0 0 0 0 0 0 0 0 0 0 0
  15113. 1.3253 0.5302 0.3167 C 0 0 0 0 0 0 0 0 0 0 0 0
  15114. 1.0589 -0.6260 -0.3994 C 0 0 0 0 0 0 0 0 0 0 0 0
  15115. -0.5180 -1.8793 -1.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
  15116. -2.3238 -0.4191 -0.2379 H 0 0 0 0 0 0 0 0 0 0 0 0
  15117. -1.6631 1.6297 1.0293 H 0 0 0 0 0 0 0 0 0 0 0 0
  15118. 2.3464 0.8490 0.5049 H 0 0 0 0 0 0 0 0 0 0 0 0
  15119. 1.8678 -1.2353 -0.7861 H 0 0 0 0 0 0 0 0 0 0 0 0
  15120. 1 2 2 0
  15121. 2 3 1 0
  15122. 3 4 2 0
  15123. 4 5 1 0
  15124. 5 6 2 0
  15125. 6 1 1 0
  15126. 1 7 1 0
  15127. 2 8 1 0
  15128. 3 9 1 0
  15129. 5 10 1 0
  15130. 6 11 1 0
  15131. M END
  15132. $$$$
  15133. RDKit 3D
  15134. 11 11 0 0 0 0 0 0 0 0999 V2000
  15135. -0.2702 -0.9763 -0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0
  15136. -1.2785 -0.1702 -0.0948 C 0 0 0 0 0 0 0 0 0 0 0 0
  15137. -0.9129 0.9622 0.6154 C 0 0 0 0 0 0 0 0 0 0 0 0
  15138. 0.3682 1.3304 0.8350 N 0 0 0 0 0 0 0 0 0 0 0 0
  15139. 1.3253 0.5282 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0
  15140. 1.0589 -0.6234 -0.4034 C 0 0 0 0 0 0 0 0 0 0 0 0
  15141. -0.5180 -1.8719 -1.1749 H 0 0 0 0 0 0 0 0 0 0 0 0
  15142. -2.3238 -0.4176 -0.2405 H 0 0 0 0 0 0 0 0 0 0 0 0
  15143. -1.6631 1.6232 1.0395 H 0 0 0 0 0 0 0 0 0 0 0 0
  15144. 2.3464 0.8458 0.5102 H 0 0 0 0 0 0 0 0 0 0 0 0
  15145. 1.8678 -1.2303 -0.7938 H 0 0 0 0 0 0 0 0 0 0 0 0
  15146. 1 2 2 0
  15147. 2 3 1 0
  15148. 3 4 2 0
  15149. 4 5 1 0
  15150. 5 6 2 0
  15151. 6 1 1 0
  15152. 1 7 1 0
  15153. 2 8 1 0
  15154. 3 9 1 0
  15155. 5 10 1 0
  15156. 6 11 1 0
  15157. M END
  15158. $$$$
  15159. RDKit 3D
  15160. 11 11 0 0 0 0 0 0 0 0999 V2000
  15161. -0.2702 -0.9724 -0.6189 C 0 0 0 0 0 0 0 0 0 0 0 0
  15162. -1.2785 -0.1696 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
  15163. -0.9129 0.9583 0.6215 C 0 0 0 0 0 0 0 0 0 0 0 0
  15164. 0.3682 1.3251 0.8434 N 0 0 0 0 0 0 0 0 0 0 0 0
  15165. 1.3253 0.5262 0.3233 C 0 0 0 0 0 0 0 0 0 0 0 0
  15166. 1.0589 -0.6209 -0.4073 C 0 0 0 0 0 0 0 0 0 0 0 0
  15167. -0.5180 -1.8645 -1.1867 H 0 0 0 0 0 0 0 0 0 0 0 0
  15168. -2.3238 -0.4161 -0.2431 H 0 0 0 0 0 0 0 0 0 0 0 0
  15169. -1.6631 1.6167 1.0497 H 0 0 0 0 0 0 0 0 0 0 0 0
  15170. 2.3464 0.8426 0.5155 H 0 0 0 0 0 0 0 0 0 0 0 0
  15171. 1.8678 -1.2253 -0.8015 H 0 0 0 0 0 0 0 0 0 0 0 0
  15172. 1 2 2 0
  15173. 2 3 1 0
  15174. 3 4 2 0
  15175. 4 5 1 0
  15176. 5 6 2 0
  15177. 6 1 1 0
  15178. 1 7 1 0
  15179. 2 8 1 0
  15180. 3 9 1 0
  15181. 5 10 1 0
  15182. 6 11 1 0
  15183. M END
  15184. $$$$
  15185. RDKit 3D
  15186. 11 11 0 0 0 0 0 0 0 0999 V2000
  15187. -0.2702 -0.9685 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0
  15188. -1.2785 -0.1690 -0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0
  15189. -0.9129 0.9543 0.6275 C 0 0 0 0 0 0 0 0 0 0 0 0
  15190. 0.3682 1.3198 0.8517 N 0 0 0 0 0 0 0 0 0 0 0 0
  15191. 1.3253 0.5241 0.3266 C 0 0 0 0 0 0 0 0 0 0 0 0
  15192. 1.0589 -0.6183 -0.4112 C 0 0 0 0 0 0 0 0 0 0 0 0
  15193. -0.5180 -1.8570 -1.1983 H 0 0 0 0 0 0 0 0 0 0 0 0
  15194. -2.3238 -0.4145 -0.2457 H 0 0 0 0 0 0 0 0 0 0 0 0
  15195. -1.6631 1.6100 1.0598 H 0 0 0 0 0 0 0 0 0 0 0 0
  15196. 2.3464 0.8393 0.5208 H 0 0 0 0 0 0 0 0 0 0 0 0
  15197. 1.8678 -1.2202 -0.8092 H 0 0 0 0 0 0 0 0 0 0 0 0
  15198. 1 2 2 0
  15199. 2 3 1 0
  15200. 3 4 2 0
  15201. 4 5 1 0
  15202. 5 6 2 0
  15203. 6 1 1 0
  15204. 1 7 1 0
  15205. 2 8 1 0
  15206. 3 9 1 0
  15207. 5 10 1 0
  15208. 6 11 1 0
  15209. M END
  15210. $$$$
  15211. RDKit 3D
  15212. 11 11 0 0 0 0 0 0 0 0999 V2000
  15213. -0.2702 -0.9646 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0
  15214. -1.2785 -0.1684 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  15215. -0.9129 0.9504 0.6335 C 0 0 0 0 0 0 0 0 0 0 0 0
  15216. 0.3682 1.3144 0.8599 N 0 0 0 0 0 0 0 0 0 0 0 0
  15217. 1.3253 0.5221 0.3299 C 0 0 0 0 0 0 0 0 0 0 0 0
  15218. 1.0589 -0.6157 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0
  15219. -0.5180 -1.8495 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  15220. -2.3238 -0.4130 -0.2483 H 0 0 0 0 0 0 0 0 0 0 0 0
  15221. -1.6631 1.6033 1.0699 H 0 0 0 0 0 0 0 0 0 0 0 0
  15222. 2.3464 0.8361 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0
  15223. 1.8678 -1.2151 -0.8169 H 0 0 0 0 0 0 0 0 0 0 0 0
  15224. 1 2 2 0
  15225. 2 3 1 0
  15226. 3 4 2 0
  15227. 4 5 1 0
  15228. 5 6 2 0
  15229. 6 1 1 0
  15230. 1 7 1 0
  15231. 2 8 1 0
  15232. 3 9 1 0
  15233. 5 10 1 0
  15234. 6 11 1 0
  15235. M END
  15236. $$$$
  15237. RDKit 3D
  15238. 11 11 0 0 0 0 0 0 0 0999 V2000
  15239. -0.2702 -0.9606 -0.6371 C 0 0 0 0 0 0 0 0 0 0 0 0
  15240. -1.2785 -0.1678 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0
  15241. -0.9129 0.9464 0.6394 C 0 0 0 0 0 0 0 0 0 0 0 0
  15242. 0.3682 1.3090 0.8682 N 0 0 0 0 0 0 0 0 0 0 0 0
  15243. 1.3253 0.5200 0.3331 C 0 0 0 0 0 0 0 0 0 0 0 0
  15244. 1.0589 -0.6131 -0.4189 C 0 0 0 0 0 0 0 0 0 0 0 0
  15245. -0.5180 -1.8418 -1.2216 H 0 0 0 0 0 0 0 0 0 0 0 0
  15246. -2.3238 -0.4114 -0.2509 H 0 0 0 0 0 0 0 0 0 0 0 0
  15247. -1.6631 1.5966 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0
  15248. 2.3464 0.8327 0.5313 H 0 0 0 0 0 0 0 0 0 0 0 0
  15249. 1.8678 -1.2100 -0.8245 H 0 0 0 0 0 0 0 0 0 0 0 0
  15250. 1 2 2 0
  15251. 2 3 1 0
  15252. 3 4 2 0
  15253. 4 5 1 0
  15254. 5 6 2 0
  15255. 6 1 1 0
  15256. 1 7 1 0
  15257. 2 8 1 0
  15258. 3 9 1 0
  15259. 5 10 1 0
  15260. 6 11 1 0
  15261. M END
  15262. $$$$
  15263. RDKit 3D
  15264. 11 11 0 0 0 0 0 0 0 0999 V2000
  15265. -0.2702 -0.9565 -0.6431 C 0 0 0 0 0 0 0 0 0 0 0 0
  15266. -1.2785 -0.1672 -0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0
  15267. -0.9129 0.9424 0.6454 C 0 0 0 0 0 0 0 0 0 0 0 0
  15268. 0.3682 1.3035 0.8764 N 0 0 0 0 0 0 0 0 0 0 0 0
  15269. 1.3253 0.5179 0.3364 C 0 0 0 0 0 0 0 0 0 0 0 0
  15270. 1.0589 -0.6105 -0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0
  15271. -0.5180 -1.8341 -1.2331 H 0 0 0 0 0 0 0 0 0 0 0 0
  15272. -2.3238 -0.4098 -0.2535 H 0 0 0 0 0 0 0 0 0 0 0 0
  15273. -1.6631 1.5898 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0
  15274. 2.3464 0.8294 0.5365 H 0 0 0 0 0 0 0 0 0 0 0 0
  15275. 1.8678 -1.2048 -0.8321 H 0 0 0 0 0 0 0 0 0 0 0 0
  15276. 1 2 2 0
  15277. 2 3 1 0
  15278. 3 4 2 0
  15279. 4 5 1 0
  15280. 5 6 2 0
  15281. 6 1 1 0
  15282. 1 7 1 0
  15283. 2 8 1 0
  15284. 3 9 1 0
  15285. 5 10 1 0
  15286. 6 11 1 0
  15287. M END
  15288. $$$$
  15289. RDKit 3D
  15290. 11 11 0 0 0 0 0 0 0 0999 V2000
  15291. -0.2702 -0.9525 -0.6491 C 0 0 0 0 0 0 0 0 0 0 0 0
  15292. -1.2785 -0.1665 -0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
  15293. -0.9129 0.9383 0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0
  15294. 0.3682 1.2980 0.8846 N 0 0 0 0 0 0 0 0 0 0 0 0
  15295. 1.3253 0.5158 0.3397 C 0 0 0 0 0 0 0 0 0 0 0 0
  15296. 1.0589 -0.6078 -0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0
  15297. -0.5180 -1.8263 -1.2446 H 0 0 0 0 0 0 0 0 0 0 0 0
  15298. -2.3238 -0.4082 -0.2561 H 0 0 0 0 0 0 0 0 0 0 0 0
  15299. -1.6631 1.5829 1.0999 H 0 0 0 0 0 0 0 0 0 0 0 0
  15300. 2.3464 0.8260 0.5417 H 0 0 0 0 0 0 0 0 0 0 0 0
  15301. 1.8678 -1.1995 -0.8396 H 0 0 0 0 0 0 0 0 0 0 0 0
  15302. 1 2 2 0
  15303. 2 3 1 0
  15304. 3 4 2 0
  15305. 4 5 1 0
  15306. 5 6 2 0
  15307. 6 1 1 0
  15308. 1 7 1 0
  15309. 2 8 1 0
  15310. 3 9 1 0
  15311. 5 10 1 0
  15312. 6 11 1 0
  15313. M END
  15314. $$$$
  15315. RDKit 3D
  15316. 11 11 0 0 0 0 0 0 0 0999 V2000
  15317. -0.2702 -0.9484 -0.6551 C 0 0 0 0 0 0 0 0 0 0 0 0
  15318. -1.2785 -0.1659 -0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0
  15319. -0.9129 0.9342 0.6571 C 0 0 0 0 0 0 0 0 0 0 0 0
  15320. 0.3682 1.2924 0.8927 N 0 0 0 0 0 0 0 0 0 0 0 0
  15321. 1.3253 0.5136 0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0
  15322. 1.0589 -0.6051 -0.4304 C 0 0 0 0 0 0 0 0 0 0 0 0
  15323. -0.5180 -1.8185 -1.2561 H 0 0 0 0 0 0 0 0 0 0 0 0
  15324. -2.3238 -0.4066 -0.2586 H 0 0 0 0 0 0 0 0 0 0 0 0
  15325. -1.6631 1.5760 1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0
  15326. 2.3464 0.8226 0.5469 H 0 0 0 0 0 0 0 0 0 0 0 0
  15327. 1.8678 -1.1942 -0.8471 H 0 0 0 0 0 0 0 0 0 0 0 0
  15328. 1 2 2 0
  15329. 2 3 1 0
  15330. 3 4 2 0
  15331. 4 5 1 0
  15332. 5 6 2 0
  15333. 6 1 1 0
  15334. 1 7 1 0
  15335. 2 8 1 0
  15336. 3 9 1 0
  15337. 5 10 1 0
  15338. 6 11 1 0
  15339. M END
  15340. $$$$
  15341. RDKit 3D
  15342. 11 11 0 0 0 0 0 0 0 0999 V2000
  15343. -0.2702 -0.9443 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0
  15344. -1.2785 -0.1653 -0.1032 C 0 0 0 0 0 0 0 0 0 0 0 0
  15345. -0.9129 0.9300 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0
  15346. 0.3682 1.2868 0.9008 N 0 0 0 0 0 0 0 0 0 0 0 0
  15347. 1.3253 0.5115 0.3461 C 0 0 0 0 0 0 0 0 0 0 0 0
  15348. 1.0589 -0.6024 -0.4342 C 0 0 0 0 0 0 0 0 0 0 0 0
  15349. -0.5180 -1.8105 -1.2675 H 0 0 0 0 0 0 0 0 0 0 0 0
  15350. -2.3238 -0.4050 -0.2612 H 0 0 0 0 0 0 0 0 0 0 0 0
  15351. -1.6631 1.5689 1.1197 H 0 0 0 0 0 0 0 0 0 0 0 0
  15352. 2.3464 0.8191 0.5521 H 0 0 0 0 0 0 0 0 0 0 0 0
  15353. 1.8678 -1.1889 -0.8546 H 0 0 0 0 0 0 0 0 0 0 0 0
  15354. 1 2 2 0
  15355. 2 3 1 0
  15356. 3 4 2 0
  15357. 4 5 1 0
  15358. 5 6 2 0
  15359. 6 1 1 0
  15360. 1 7 1 0
  15361. 2 8 1 0
  15362. 3 9 1 0
  15363. 5 10 1 0
  15364. 6 11 1 0
  15365. M END
  15366. $$$$
  15367. RDKit 3D
  15368. 11 11 0 0 0 0 0 0 0 0999 V2000
  15369. -0.2702 -0.9401 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0
  15370. -1.2785 -0.1646 -0.1043 C 0 0 0 0 0 0 0 0 0 0 0 0
  15371. -0.9129 0.9258 0.6688 C 0 0 0 0 0 0 0 0 0 0 0 0
  15372. 0.3682 1.2811 0.9089 N 0 0 0 0 0 0 0 0 0 0 0 0
  15373. 1.3253 0.5093 0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0
  15374. 1.0589 -0.5996 -0.4379 C 0 0 0 0 0 0 0 0 0 0 0 0
  15375. -0.5180 -1.8025 -1.2788 H 0 0 0 0 0 0 0 0 0 0 0 0
  15376. -2.3238 -0.4033 -0.2637 H 0 0 0 0 0 0 0 0 0 0 0 0
  15377. -1.6631 1.5619 1.1296 H 0 0 0 0 0 0 0 0 0 0 0 0
  15378. 2.3464 0.8156 0.5572 H 0 0 0 0 0 0 0 0 0 0 0 0
  15379. 1.8678 -1.1835 -0.8621 H 0 0 0 0 0 0 0 0 0 0 0 0
  15380. 1 2 2 0
  15381. 2 3 1 0
  15382. 3 4 2 0
  15383. 4 5 1 0
  15384. 5 6 2 0
  15385. 6 1 1 0
  15386. 1 7 1 0
  15387. 2 8 1 0
  15388. 3 9 1 0
  15389. 5 10 1 0
  15390. 6 11 1 0
  15391. M END
  15392. $$$$
  15393. RDKit 3D
  15394. 11 11 0 0 0 0 0 0 0 0999 V2000
  15395. -0.2702 -0.9359 -0.6728 C 0 0 0 0 0 0 0 0 0 0 0 0
  15396. -1.2785 -0.1640 -0.1053 C 0 0 0 0 0 0 0 0 0 0 0 0
  15397. -0.9129 0.9216 0.6746 C 0 0 0 0 0 0 0 0 0 0 0 0
  15398. 0.3682 1.2753 0.9169 N 0 0 0 0 0 0 0 0 0 0 0 0
  15399. 1.3253 0.5071 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0
  15400. 1.0589 -0.5969 -0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0
  15401. -0.5180 -1.7945 -1.2901 H 0 0 0 0 0 0 0 0 0 0 0 0
  15402. -2.3238 -0.4017 -0.2662 H 0 0 0 0 0 0 0 0 0 0 0 0
  15403. -1.6631 1.5548 1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0
  15404. 2.3464 0.8121 0.5623 H 0 0 0 0 0 0 0 0 0 0 0 0
  15405. 1.8678 -1.1780 -0.8695 H 0 0 0 0 0 0 0 0 0 0 0 0
  15406. 1 2 2 0
  15407. 2 3 1 0
  15408. 3 4 2 0
  15409. 4 5 1 0
  15410. 5 6 2 0
  15411. 6 1 1 0
  15412. 1 7 1 0
  15413. 2 8 1 0
  15414. 3 9 1 0
  15415. 5 10 1 0
  15416. 6 11 1 0
  15417. M END
  15418. $$$$
  15419. RDKit 3D
  15420. 11 11 0 0 0 0 0 0 0 0999 V2000
  15421. -0.2702 -0.9316 -0.6787 C 0 0 0 0 0 0 0 0 0 0 0 0
  15422. -1.2785 -0.1633 -0.1063 C 0 0 0 0 0 0 0 0 0 0 0 0
  15423. -0.9129 0.9174 0.6804 C 0 0 0 0 0 0 0 0 0 0 0 0
  15424. 0.3682 1.2695 0.9249 N 0 0 0 0 0 0 0 0 0 0 0 0
  15425. 1.3253 0.5048 0.3557 C 0 0 0 0 0 0 0 0 0 0 0 0
  15426. 1.0589 -0.5941 -0.4454 C 0 0 0 0 0 0 0 0 0 0 0 0
  15427. -0.5180 -1.7863 -1.3014 H 0 0 0 0 0 0 0 0 0 0 0 0
  15428. -2.3238 -0.4000 -0.2688 H 0 0 0 0 0 0 0 0 0 0 0 0
  15429. -1.6631 1.5476 1.1491 H 0 0 0 0 0 0 0 0 0 0 0 0
  15430. 2.3464 0.8086 0.5674 H 0 0 0 0 0 0 0 0 0 0 0 0
  15431. 1.8678 -1.1725 -0.8769 H 0 0 0 0 0 0 0 0 0 0 0 0
  15432. 1 2 2 0
  15433. 2 3 1 0
  15434. 3 4 2 0
  15435. 4 5 1 0
  15436. 5 6 2 0
  15437. 6 1 1 0
  15438. 1 7 1 0
  15439. 2 8 1 0
  15440. 3 9 1 0
  15441. 5 10 1 0
  15442. 6 11 1 0
  15443. M END
  15444. $$$$
  15445. RDKit 3D
  15446. 11 11 0 0 0 0 0 0 0 0999 V2000
  15447. -0.2702 -0.9273 -0.6846 C 0 0 0 0 0 0 0 0 0 0 0 0
  15448. -1.2785 -0.1626 -0.1074 C 0 0 0 0 0 0 0 0 0 0 0 0
  15449. -0.9129 0.9131 0.6862 C 0 0 0 0 0 0 0 0 0 0 0 0
  15450. 0.3682 1.2637 0.9329 N 0 0 0 0 0 0 0 0 0 0 0 0
  15451. 1.3253 0.5026 0.3589 C 0 0 0 0 0 0 0 0 0 0 0 0
  15452. 1.0589 -0.5913 -0.4492 C 0 0 0 0 0 0 0 0 0 0 0 0
  15453. -0.5180 -1.7781 -1.3126 H 0 0 0 0 0 0 0 0 0 0 0 0
  15454. -2.3238 -0.3983 -0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0
  15455. -1.6631 1.5403 1.1588 H 0 0 0 0 0 0 0 0 0 0 0 0
  15456. 2.3464 0.8050 0.5725 H 0 0 0 0 0 0 0 0 0 0 0 0
  15457. 1.8678 -1.1670 -0.8842 H 0 0 0 0 0 0 0 0 0 0 0 0
  15458. 1 2 2 0
  15459. 2 3 1 0
  15460. 3 4 2 0
  15461. 4 5 1 0
  15462. 5 6 2 0
  15463. 6 1 1 0
  15464. 1 7 1 0
  15465. 2 8 1 0
  15466. 3 9 1 0
  15467. 5 10 1 0
  15468. 6 11 1 0
  15469. M END
  15470. $$$$
  15471. RDKit 3D
  15472. 11 11 0 0 0 0 0 0 0 0999 V2000
  15473. -0.2702 -0.9230 -0.6904 C 0 0 0 0 0 0 0 0 0 0 0 0
  15474. -1.2785 -0.1619 -0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0
  15475. -0.9129 0.9087 0.6919 C 0 0 0 0 0 0 0 0 0 0 0 0
  15476. 0.3682 1.2578 0.9408 N 0 0 0 0 0 0 0 0 0 0 0 0
  15477. 1.3253 0.5003 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0
  15478. 1.0589 -0.5885 -0.4529 C 0 0 0 0 0 0 0 0 0 0 0 0
  15479. -0.5180 -1.7698 -1.3237 H 0 0 0 0 0 0 0 0 0 0 0 0
  15480. -2.3238 -0.3966 -0.2738 H 0 0 0 0 0 0 0 0 0 0 0 0
  15481. -1.6631 1.5330 1.1685 H 0 0 0 0 0 0 0 0 0 0 0 0
  15482. 2.3464 0.8014 0.5775 H 0 0 0 0 0 0 0 0 0 0 0 0
  15483. 1.8678 -1.1614 -0.8915 H 0 0 0 0 0 0 0 0 0 0 0 0
  15484. 1 2 2 0
  15485. 2 3 1 0
  15486. 3 4 2 0
  15487. 4 5 1 0
  15488. 5 6 2 0
  15489. 6 1 1 0
  15490. 1 7 1 0
  15491. 2 8 1 0
  15492. 3 9 1 0
  15493. 5 10 1 0
  15494. 6 11 1 0
  15495. M END
  15496. $$$$
  15497. RDKit 3D
  15498. 11 11 0 0 0 0 0 0 0 0999 V2000
  15499. -0.2702 -0.9187 -0.6962 C 0 0 0 0 0 0 0 0 0 0 0 0
  15500. -1.2785 -0.1613 -0.1094 C 0 0 0 0 0 0 0 0 0 0 0 0
  15501. -0.9129 0.9044 0.6976 C 0 0 0 0 0 0 0 0 0 0 0 0
  15502. 0.3682 1.2519 0.9487 N 0 0 0 0 0 0 0 0 0 0 0 0
  15503. 1.3253 0.4980 0.3651 C 0 0 0 0 0 0 0 0 0 0 0 0
  15504. 1.0589 -0.5856 -0.4566 C 0 0 0 0 0 0 0 0 0 0 0 0
  15505. -0.5180 -1.7615 -1.3348 H 0 0 0 0 0 0 0 0 0 0 0 0
  15506. -2.3238 -0.3949 -0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0
  15507. -1.6631 1.5256 1.1781 H 0 0 0 0 0 0 0 0 0 0 0 0
  15508. 2.3464 0.7977 0.5825 H 0 0 0 0 0 0 0 0 0 0 0 0
  15509. 1.8678 -1.1558 -0.8988 H 0 0 0 0 0 0 0 0 0 0 0 0
  15510. 1 2 2 0
  15511. 2 3 1 0
  15512. 3 4 2 0
  15513. 4 5 1 0
  15514. 5 6 2 0
  15515. 6 1 1 0
  15516. 1 7 1 0
  15517. 2 8 1 0
  15518. 3 9 1 0
  15519. 5 10 1 0
  15520. 6 11 1 0
  15521. M END
  15522. $$$$
  15523. RDKit 3D
  15524. 11 11 0 0 0 0 0 0 0 0999 V2000
  15525. -0.2702 -0.9143 -0.7019 C 0 0 0 0 0 0 0 0 0 0 0 0
  15526. -1.2785 -0.1606 -0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0
  15527. -0.9129 0.9000 0.7033 C 0 0 0 0 0 0 0 0 0 0 0 0
  15528. 0.3682 1.2459 0.9565 N 0 0 0 0 0 0 0 0 0 0 0 0
  15529. 1.3253 0.4957 0.3683 C 0 0 0 0 0 0 0 0 0 0 0 0
  15530. 1.0589 -0.5827 -0.4602 C 0 0 0 0 0 0 0 0 0 0 0 0
  15531. -0.5180 -1.7531 -1.3459 H 0 0 0 0 0 0 0 0 0 0 0 0
  15532. -2.3238 -0.3931 -0.2787 H 0 0 0 0 0 0 0 0 0 0 0 0
  15533. -1.6631 1.5182 1.1876 H 0 0 0 0 0 0 0 0 0 0 0 0
  15534. 2.3464 0.7941 0.5875 H 0 0 0 0 0 0 0 0 0 0 0 0
  15535. 1.8678 -1.1501 -0.9061 H 0 0 0 0 0 0 0 0 0 0 0 0
  15536. 1 2 2 0
  15537. 2 3 1 0
  15538. 3 4 2 0
  15539. 4 5 1 0
  15540. 5 6 2 0
  15541. 6 1 1 0
  15542. 1 7 1 0
  15543. 2 8 1 0
  15544. 3 9 1 0
  15545. 5 10 1 0
  15546. 6 11 1 0
  15547. M END
  15548. $$$$
  15549. RDKit 3D
  15550. 11 11 0 0 0 0 0 0 0 0999 V2000
  15551. -0.2702 -0.9098 -0.7076 C 0 0 0 0 0 0 0 0 0 0 0 0
  15552. -1.2785 -0.1599 -0.1114 C 0 0 0 0 0 0 0 0 0 0 0 0
  15553. -0.9129 0.8955 0.7089 C 0 0 0 0 0 0 0 0 0 0 0 0
  15554. 0.3682 1.2399 0.9643 N 0 0 0 0 0 0 0 0 0 0 0 0
  15555. 1.3253 0.4934 0.3714 C 0 0 0 0 0 0 0 0 0 0 0 0
  15556. 1.0589 -0.5798 -0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0
  15557. -0.5180 -1.7446 -1.3569 H 0 0 0 0 0 0 0 0 0 0 0 0
  15558. -2.3238 -0.3914 -0.2812 H 0 0 0 0 0 0 0 0 0 0 0 0
  15559. -1.6631 1.5107 1.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
  15560. 2.3464 0.7904 0.5925 H 0 0 0 0 0 0 0 0 0 0 0 0
  15561. 1.8678 -1.1444 -0.9133 H 0 0 0 0 0 0 0 0 0 0 0 0
  15562. 1 2 2 0
  15563. 2 3 1 0
  15564. 3 4 2 0
  15565. 4 5 1 0
  15566. 5 6 2 0
  15567. 6 1 1 0
  15568. 1 7 1 0
  15569. 2 8 1 0
  15570. 3 9 1 0
  15571. 5 10 1 0
  15572. 6 11 1 0
  15573. M END
  15574. $$$$
  15575. RDKit 3D
  15576. 11 11 0 0 0 0 0 0 0 0999 V2000
  15577. -0.2702 -0.9054 -0.7133 C 0 0 0 0 0 0 0 0 0 0 0 0
  15578. -1.2785 -0.1592 -0.1124 C 0 0 0 0 0 0 0 0 0 0 0 0
  15579. -0.9129 0.8911 0.7145 C 0 0 0 0 0 0 0 0 0 0 0 0
  15580. 0.3682 1.2338 0.9721 N 0 0 0 0 0 0 0 0 0 0 0 0
  15581. 1.3253 0.4911 0.3745 C 0 0 0 0 0 0 0 0 0 0 0 0
  15582. 1.0589 -0.5769 -0.4675 C 0 0 0 0 0 0 0 0 0 0 0 0
  15583. -0.5180 -1.7360 -1.3678 H 0 0 0 0 0 0 0 0 0 0 0 0
  15584. -2.3238 -0.3896 -0.2836 H 0 0 0 0 0 0 0 0 0 0 0 0
  15585. -1.6631 1.5032 1.2066 H 0 0 0 0 0 0 0 0 0 0 0 0
  15586. 2.3464 0.7866 0.5975 H 0 0 0 0 0 0 0 0 0 0 0 0
  15587. 1.8678 -1.1387 -0.9204 H 0 0 0 0 0 0 0 0 0 0 0 0
  15588. 1 2 2 0
  15589. 2 3 1 0
  15590. 3 4 2 0
  15591. 4 5 1 0
  15592. 5 6 2 0
  15593. 6 1 1 0
  15594. 1 7 1 0
  15595. 2 8 1 0
  15596. 3 9 1 0
  15597. 5 10 1 0
  15598. 6 11 1 0
  15599. M END
  15600. $$$$
  15601. RDKit 3D
  15602. 11 11 0 0 0 0 0 0 0 0999 V2000
  15603. -0.2702 -0.9009 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0
  15604. -1.2785 -0.1585 -0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0
  15605. -0.9129 0.8866 0.7201 C 0 0 0 0 0 0 0 0 0 0 0 0
  15606. 0.3682 1.2277 0.9798 N 0 0 0 0 0 0 0 0 0 0 0 0
  15607. 1.3253 0.4887 0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0
  15608. 1.0589 -0.5739 -0.4711 C 0 0 0 0 0 0 0 0 0 0 0 0
  15609. -0.5180 -1.7274 -1.3787 H 0 0 0 0 0 0 0 0 0 0 0 0
  15610. -2.3238 -0.3878 -0.2861 H 0 0 0 0 0 0 0 0 0 0 0 0
  15611. -1.6631 1.4955 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0
  15612. 2.3464 0.7828 0.6024 H 0 0 0 0 0 0 0 0 0 0 0 0
  15613. 1.8678 -1.1329 -0.9276 H 0 0 0 0 0 0 0 0 0 0 0 0
  15614. 1 2 2 0
  15615. 2 3 1 0
  15616. 3 4 2 0
  15617. 4 5 1 0
  15618. 5 6 2 0
  15619. 6 1 1 0
  15620. 1 7 1 0
  15621. 2 8 1 0
  15622. 3 9 1 0
  15623. 5 10 1 0
  15624. 6 11 1 0
  15625. M END
  15626. $$$$
  15627. RDKit 3D
  15628. 11 11 0 0 0 0 0 0 0 0999 V2000
  15629. -0.2702 -0.8963 -0.7247 C 0 0 0 0 0 0 0 0 0 0 0 0
  15630. -1.2785 -0.1577 -0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0
  15631. -0.9129 0.8820 0.7256 C 0 0 0 0 0 0 0 0 0 0 0 0
  15632. 0.3682 1.2215 0.9875 N 0 0 0 0 0 0 0 0 0 0 0 0
  15633. 1.3253 0.4863 0.3806 C 0 0 0 0 0 0 0 0 0 0 0 0
  15634. 1.0589 -0.5710 -0.4747 C 0 0 0 0 0 0 0 0 0 0 0 0
  15635. -0.5180 -1.7187 -1.3895 H 0 0 0 0 0 0 0 0 0 0 0 0
  15636. -2.3238 -0.3860 -0.2885 H 0 0 0 0 0 0 0 0 0 0 0 0
  15637. -1.6631 1.4879 1.2254 H 0 0 0 0 0 0 0 0 0 0 0 0
  15638. 2.3464 0.7790 0.6073 H 0 0 0 0 0 0 0 0 0 0 0 0
  15639. 1.8678 -1.1270 -0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0
  15640. 1 2 2 0
  15641. 2 3 1 0
  15642. 3 4 2 0
  15643. 4 5 1 0
  15644. 5 6 2 0
  15645. 6 1 1 0
  15646. 1 7 1 0
  15647. 2 8 1 0
  15648. 3 9 1 0
  15649. 5 10 1 0
  15650. 6 11 1 0
  15651. M END
  15652. $$$$
  15653. RDKit 3D
  15654. 11 11 0 0 0 0 0 0 0 0999 V2000
  15655. -0.2702 -0.8918 -0.7303 C 0 0 0 0 0 0 0 0 0 0 0 0
  15656. -1.2785 -0.1570 -0.1154 C 0 0 0 0 0 0 0 0 0 0 0 0
  15657. -0.9129 0.8774 0.7312 C 0 0 0 0 0 0 0 0 0 0 0 0
  15658. 0.3682 1.2152 0.9952 N 0 0 0 0 0 0 0 0 0 0 0 0
  15659. 1.3253 0.4839 0.3837 C 0 0 0 0 0 0 0 0 0 0 0 0
  15660. 1.0589 -0.5680 -0.4783 C 0 0 0 0 0 0 0 0 0 0 0 0
  15661. -0.5180 -1.7099 -1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
  15662. -2.3238 -0.3842 -0.2909 H 0 0 0 0 0 0 0 0 0 0 0 0
  15663. -1.6631 1.4801 1.2347 H 0 0 0 0 0 0 0 0 0 0 0 0
  15664. 2.3464 0.7752 0.6122 H 0 0 0 0 0 0 0 0 0 0 0 0
  15665. 1.8678 -1.1211 -0.9417 H 0 0 0 0 0 0 0 0 0 0 0 0
  15666. 1 2 2 0
  15667. 2 3 1 0
  15668. 3 4 2 0
  15669. 4 5 1 0
  15670. 5 6 2 0
  15671. 6 1 1 0
  15672. 1 7 1 0
  15673. 2 8 1 0
  15674. 3 9 1 0
  15675. 5 10 1 0
  15676. 6 11 1 0
  15677. M END
  15678. $$$$
  15679. RDKit 3D
  15680. 11 11 0 0 0 0 0 0 0 0999 V2000
  15681. -0.2702 -0.8872 -0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0
  15682. -1.2785 -0.1563 -0.1164 C 0 0 0 0 0 0 0 0 0 0 0 0
  15683. -0.9129 0.8728 0.7367 C 0 0 0 0 0 0 0 0 0 0 0 0
  15684. 0.3682 1.2090 1.0028 N 0 0 0 0 0 0 0 0 0 0 0 0
  15685. 1.3253 0.4815 0.3867 C 0 0 0 0 0 0 0 0 0 0 0 0
  15686. 1.0589 -0.5650 -0.4819 C 0 0 0 0 0 0 0 0 0 0 0 0
  15687. -0.5180 -1.7011 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0
  15688. -2.3238 -0.3823 -0.2933 H 0 0 0 0 0 0 0 0 0 0 0 0
  15689. -1.6631 1.4724 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
  15690. 2.3464 0.7713 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0
  15691. 1.8678 -1.1152 -0.9488 H 0 0 0 0 0 0 0 0 0 0 0 0
  15692. 1 2 2 0
  15693. 2 3 1 0
  15694. 3 4 2 0
  15695. 4 5 1 0
  15696. 5 6 2 0
  15697. 6 1 1 0
  15698. 1 7 1 0
  15699. 2 8 1 0
  15700. 3 9 1 0
  15701. 5 10 1 0
  15702. 6 11 1 0
  15703. M END
  15704. $$$$
  15705. RDKit 3D
  15706. 11 11 0 0 0 0 0 0 0 0999 V2000
  15707. -0.2702 -0.8825 -0.7414 C 0 0 0 0 0 0 0 0 0 0 0 0
  15708. -1.2785 -0.1556 -0.1173 C 0 0 0 0 0 0 0 0 0 0 0 0
  15709. -0.9129 0.8682 0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0
  15710. 0.3682 1.2026 1.0104 N 0 0 0 0 0 0 0 0 0 0 0 0
  15711. 1.3253 0.4791 0.3897 C 0 0 0 0 0 0 0 0 0 0 0 0
  15712. 1.0589 -0.5619 -0.4854 C 0 0 0 0 0 0 0 0 0 0 0 0
  15713. -0.5180 -1.6922 -1.4216 H 0 0 0 0 0 0 0 0 0 0 0 0
  15714. -2.3238 -0.3805 -0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0
  15715. -1.6631 1.4645 1.2532 H 0 0 0 0 0 0 0 0 0 0 0 0
  15716. 2.3464 0.7675 0.6219 H 0 0 0 0 0 0 0 0 0 0 0 0
  15717. 1.8678 -1.1092 -0.9558 H 0 0 0 0 0 0 0 0 0 0 0 0
  15718. 1 2 2 0
  15719. 2 3 1 0
  15720. 3 4 2 0
  15721. 4 5 1 0
  15722. 5 6 2 0
  15723. 6 1 1 0
  15724. 1 7 1 0
  15725. 2 8 1 0
  15726. 3 9 1 0
  15727. 5 10 1 0
  15728. 6 11 1 0
  15729. M END
  15730. $$$$
  15731. RDKit 3D
  15732. 11 11 0 0 0 0 0 0 0 0999 V2000
  15733. -0.2702 -0.8779 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0
  15734. -1.2785 -0.1548 -0.1183 C 0 0 0 0 0 0 0 0 0 0 0 0
  15735. -0.9129 0.8635 0.7476 C 0 0 0 0 0 0 0 0 0 0 0 0
  15736. 0.3682 1.1963 1.0179 N 0 0 0 0 0 0 0 0 0 0 0 0
  15737. 1.3253 0.4766 0.3927 C 0 0 0 0 0 0 0 0 0 0 0 0
  15738. 1.0589 -0.5589 -0.4889 C 0 0 0 0 0 0 0 0 0 0 0 0
  15739. -0.5180 -1.6832 -1.4322 H 0 0 0 0 0 0 0 0 0 0 0 0
  15740. -2.3238 -0.3786 -0.2981 H 0 0 0 0 0 0 0 0 0 0 0 0
  15741. -1.6631 1.4566 1.2624 H 0 0 0 0 0 0 0 0 0 0 0 0
  15742. 2.3464 0.7635 0.6267 H 0 0 0 0 0 0 0 0 0 0 0 0
  15743. 1.8678 -1.1032 -0.9627 H 0 0 0 0 0 0 0 0 0 0 0 0
  15744. 1 2 2 0
  15745. 2 3 1 0
  15746. 3 4 2 0
  15747. 4 5 1 0
  15748. 5 6 2 0
  15749. 6 1 1 0
  15750. 1 7 1 0
  15751. 2 8 1 0
  15752. 3 9 1 0
  15753. 5 10 1 0
  15754. 6 11 1 0
  15755. M END
  15756. $$$$
  15757. RDKit 3D
  15758. 11 11 0 0 0 0 0 0 0 0999 V2000
  15759. -0.2702 -0.8731 -0.7525 C 0 0 0 0 0 0 0 0 0 0 0 0
  15760. -1.2785 -0.1541 -0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0
  15761. -0.9129 0.8588 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0
  15762. 0.3682 1.1899 1.0254 N 0 0 0 0 0 0 0 0 0 0 0 0
  15763. 1.3253 0.4741 0.3957 C 0 0 0 0 0 0 0 0 0 0 0 0
  15764. 1.0589 -0.5558 -0.4924 C 0 0 0 0 0 0 0 0 0 0 0 0
  15765. -0.5180 -1.6742 -1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0
  15766. -2.3238 -0.3767 -0.3005 H 0 0 0 0 0 0 0 0 0 0 0 0
  15767. -1.6631 1.4486 1.2715 H 0 0 0 0 0 0 0 0 0 0 0 0
  15768. 2.3464 0.7596 0.6315 H 0 0 0 0 0 0 0 0 0 0 0 0
  15769. 1.8678 -1.0971 -0.9696 H 0 0 0 0 0 0 0 0 0 0 0 0
  15770. 1 2 2 0
  15771. 2 3 1 0
  15772. 3 4 2 0
  15773. 4 5 1 0
  15774. 5 6 2 0
  15775. 6 1 1 0
  15776. 1 7 1 0
  15777. 2 8 1 0
  15778. 3 9 1 0
  15779. 5 10 1 0
  15780. 6 11 1 0
  15781. M END
  15782. $$$$
  15783. RDKit 3D
  15784. 11 11 0 0 0 0 0 0 0 0999 V2000
  15785. -0.2702 -0.8684 -0.7579 C 0 0 0 0 0 0 0 0 0 0 0 0
  15786. -1.2785 -0.1533 -0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0
  15787. -0.9129 0.8540 0.7584 C 0 0 0 0 0 0 0 0 0 0 0 0
  15788. 0.3682 1.1834 1.0329 N 0 0 0 0 0 0 0 0 0 0 0 0
  15789. 1.3253 0.4716 0.3987 C 0 0 0 0 0 0 0 0 0 0 0 0
  15790. 1.0589 -0.5527 -0.4959 C 0 0 0 0 0 0 0 0 0 0 0 0
  15791. -0.5180 -1.6651 -1.4533 H 0 0 0 0 0 0 0 0 0 0 0 0
  15792. -2.3238 -0.3748 -0.3029 H 0 0 0 0 0 0 0 0 0 0 0 0
  15793. -1.6631 1.4406 1.2806 H 0 0 0 0 0 0 0 0 0 0 0 0
  15794. 2.3464 0.7556 0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0
  15795. 1.8678 -1.0910 -0.9765 H 0 0 0 0 0 0 0 0 0 0 0 0
  15796. 1 2 2 0
  15797. 2 3 1 0
  15798. 3 4 2 0
  15799. 4 5 1 0
  15800. 5 6 2 0
  15801. 6 1 1 0
  15802. 1 7 1 0
  15803. 2 8 1 0
  15804. 3 9 1 0
  15805. 5 10 1 0
  15806. 6 11 1 0
  15807. M END
  15808. $$$$
  15809. RDKit 3D
  15810. 11 11 0 0 0 0 0 0 0 0999 V2000
  15811. -0.2702 -0.8636 -0.7634 C 0 0 0 0 0 0 0 0 0 0 0 0
  15812. -1.2785 -0.1526 -0.1212 C 0 0 0 0 0 0 0 0 0 0 0 0
  15813. -0.9129 0.8493 0.7637 C 0 0 0 0 0 0 0 0 0 0 0 0
  15814. 0.3682 1.1769 1.0403 N 0 0 0 0 0 0 0 0 0 0 0 0
  15815. 1.3253 0.4691 0.4016 C 0 0 0 0 0 0 0 0 0 0 0 0
  15816. 1.0589 -0.5495 -0.4994 C 0 0 0 0 0 0 0 0 0 0 0 0
  15817. -0.5180 -1.6559 -1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  15818. -2.3238 -0.3729 -0.3052 H 0 0 0 0 0 0 0 0 0 0 0 0
  15819. -1.6631 1.4326 1.2896 H 0 0 0 0 0 0 0 0 0 0 0 0
  15820. 2.3464 0.7516 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0
  15821. 1.8678 -1.0848 -0.9833 H 0 0 0 0 0 0 0 0 0 0 0 0
  15822. 1 2 2 0
  15823. 2 3 1 0
  15824. 3 4 2 0
  15825. 4 5 1 0
  15826. 5 6 2 0
  15827. 6 1 1 0
  15828. 1 7 1 0
  15829. 2 8 1 0
  15830. 3 9 1 0
  15831. 5 10 1 0
  15832. 6 11 1 0
  15833. M END
  15834. $$$$
  15835. RDKit 3D
  15836. 11 11 0 0 0 0 0 0 0 0999 V2000
  15837. -0.2702 -0.8588 -0.7688 C 0 0 0 0 0 0 0 0 0 0 0 0
  15838. -1.2785 -0.1518 -0.1222 C 0 0 0 0 0 0 0 0 0 0 0 0
  15839. -0.9129 0.8444 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0
  15840. 0.3682 1.1703 1.0476 N 0 0 0 0 0 0 0 0 0 0 0 0
  15841. 1.3253 0.4666 0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0
  15842. 1.0589 -0.5464 -0.5028 C 0 0 0 0 0 0 0 0 0 0 0 0
  15843. -0.5180 -1.6467 -1.4741 H 0 0 0 0 0 0 0 0 0 0 0 0
  15844. -2.3238 -0.3710 -0.3075 H 0 0 0 0 0 0 0 0 0 0 0 0
  15845. -1.6631 1.4244 1.2986 H 0 0 0 0 0 0 0 0 0 0 0 0
  15846. 2.3464 0.7475 0.6457 H 0 0 0 0 0 0 0 0 0 0 0 0
  15847. 1.8678 -1.0786 -0.9901 H 0 0 0 0 0 0 0 0 0 0 0 0
  15848. 1 2 2 0
  15849. 2 3 1 0
  15850. 3 4 2 0
  15851. 4 5 1 0
  15852. 5 6 2 0
  15853. 6 1 1 0
  15854. 1 7 1 0
  15855. 2 8 1 0
  15856. 3 9 1 0
  15857. 5 10 1 0
  15858. 6 11 1 0
  15859. M END
  15860. $$$$
  15861. RDKit 3D
  15862. 11 11 0 0 0 0 0 0 0 0999 V2000
  15863. -0.2702 -0.8540 -0.7742 C 0 0 0 0 0 0 0 0 0 0 0 0
  15864. -1.2785 -0.1510 -0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0
  15865. -0.9129 0.8396 0.7743 C 0 0 0 0 0 0 0 0 0 0 0 0
  15866. 0.3682 1.1637 1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0
  15867. 1.3253 0.4640 0.4075 C 0 0 0 0 0 0 0 0 0 0 0 0
  15868. 1.0589 -0.5432 -0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0
  15869. -0.5180 -1.6374 -1.4844 H 0 0 0 0 0 0 0 0 0 0 0 0
  15870. -2.3238 -0.3691 -0.3099 H 0 0 0 0 0 0 0 0 0 0 0 0
  15871. -1.6631 1.4162 1.3075 H 0 0 0 0 0 0 0 0 0 0 0 0
  15872. 2.3464 0.7435 0.6504 H 0 0 0 0 0 0 0 0 0 0 0 0
  15873. 1.8678 -1.0724 -0.9969 H 0 0 0 0 0 0 0 0 0 0 0 0
  15874. 1 2 2 0
  15875. 2 3 1 0
  15876. 3 4 2 0
  15877. 4 5 1 0
  15878. 5 6 2 0
  15879. 6 1 1 0
  15880. 1 7 1 0
  15881. 2 8 1 0
  15882. 3 9 1 0
  15883. 5 10 1 0
  15884. 6 11 1 0
  15885. M END
  15886. $$$$
  15887. RDKit 3D
  15888. 11 11 0 0 0 0 0 0 0 0999 V2000
  15889. -0.2702 -0.8491 -0.7795 C 0 0 0 0 0 0 0 0 0 0 0 0
  15890. -1.2785 -0.1502 -0.1241 C 0 0 0 0 0 0 0 0 0 0 0 0
  15891. -0.9129 0.8347 0.7796 C 0 0 0 0 0 0 0 0 0 0 0 0
  15892. 0.3682 1.1571 1.0623 N 0 0 0 0 0 0 0 0 0 0 0 0
  15893. 1.3253 0.4615 0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0
  15894. 1.0589 -0.5400 -0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0
  15895. -0.5180 -1.6280 -1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0
  15896. -2.3238 -0.3671 -0.3122 H 0 0 0 0 0 0 0 0 0 0 0 0
  15897. -1.6631 1.4080 1.3164 H 0 0 0 0 0 0 0 0 0 0 0 0
  15898. 2.3464 0.7394 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0
  15899. 1.8678 -1.0661 -1.0036 H 0 0 0 0 0 0 0 0 0 0 0 0
  15900. 1 2 2 0
  15901. 2 3 1 0
  15902. 3 4 2 0
  15903. 4 5 1 0
  15904. 5 6 2 0
  15905. 6 1 1 0
  15906. 1 7 1 0
  15907. 2 8 1 0
  15908. 3 9 1 0
  15909. 5 10 1 0
  15910. 6 11 1 0
  15911. M END
  15912. $$$$
  15913. RDKit 3D
  15914. 11 11 0 0 0 0 0 0 0 0999 V2000
  15915. -0.2702 -0.8442 -0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0
  15916. -1.2785 -0.1495 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0
  15917. -0.9129 0.8298 0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0
  15918. 0.3682 1.1504 1.0695 N 0 0 0 0 0 0 0 0 0 0 0 0
  15919. 1.3253 0.4589 0.4133 C 0 0 0 0 0 0 0 0 0 0 0 0
  15920. 1.0589 -0.5368 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0
  15921. -0.5180 -1.6186 -1.5049 H 0 0 0 0 0 0 0 0 0 0 0 0
  15922. -2.3238 -0.3651 -0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0
  15923. -1.6631 1.3997 1.3252 H 0 0 0 0 0 0 0 0 0 0 0 0
  15924. 2.3464 0.7352 0.6597 H 0 0 0 0 0 0 0 0 0 0 0 0
  15925. 1.8678 -1.0598 -1.0103 H 0 0 0 0 0 0 0 0 0 0 0 0
  15926. 1 2 2 0
  15927. 2 3 1 0
  15928. 3 4 2 0
  15929. 4 5 1 0
  15930. 5 6 2 0
  15931. 6 1 1 0
  15932. 1 7 1 0
  15933. 2 8 1 0
  15934. 3 9 1 0
  15935. 5 10 1 0
  15936. 6 11 1 0
  15937. M END
  15938. $$$$
  15939. RDKit 3D
  15940. 11 11 0 0 0 0 0 0 0 0999 V2000
  15941. -0.2702 -0.8392 -0.7901 C 0 0 0 0 0 0 0 0 0 0 0 0
  15942. -1.2785 -0.1487 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0
  15943. -0.9129 0.8248 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0
  15944. 0.3682 1.1436 1.0767 N 0 0 0 0 0 0 0 0 0 0 0 0
  15945. 1.3253 0.4563 0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0
  15946. 1.0589 -0.5336 -0.5164 C 0 0 0 0 0 0 0 0 0 0 0 0
  15947. -0.5180 -1.6091 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0
  15948. -2.3238 -0.3632 -0.3168 H 0 0 0 0 0 0 0 0 0 0 0 0
  15949. -1.6631 1.3913 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  15950. 2.3464 0.7311 0.6643 H 0 0 0 0 0 0 0 0 0 0 0 0
  15951. 1.8678 -1.0534 -1.0169 H 0 0 0 0 0 0 0 0 0 0 0 0
  15952. 1 2 2 0
  15953. 2 3 1 0
  15954. 3 4 2 0
  15955. 4 5 1 0
  15956. 5 6 2 0
  15957. 6 1 1 0
  15958. 1 7 1 0
  15959. 2 8 1 0
  15960. 3 9 1 0
  15961. 5 10 1 0
  15962. 6 11 1 0
  15963. M END
  15964. $$$$
  15965. RDKit 3D
  15966. 11 11 0 0 0 0 0 0 0 0999 V2000
  15967. -0.2702 -0.8342 -0.7954 C 0 0 0 0 0 0 0 0 0 0 0 0
  15968. -1.2785 -0.1479 -0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0
  15969. -0.9129 0.8199 0.7952 C 0 0 0 0 0 0 0 0 0 0 0 0
  15970. 0.3682 1.1368 1.0839 N 0 0 0 0 0 0 0 0 0 0 0 0
  15971. 1.3253 0.4537 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0
  15972. 1.0589 -0.5303 -0.5197 C 0 0 0 0 0 0 0 0 0 0 0 0
  15973. -0.5180 -1.5996 -1.5251 H 0 0 0 0 0 0 0 0 0 0 0 0
  15974. -2.3238 -0.3612 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0
  15975. -1.6631 1.3829 1.3427 H 0 0 0 0 0 0 0 0 0 0 0 0
  15976. 2.3464 0.7269 0.6688 H 0 0 0 0 0 0 0 0 0 0 0 0
  15977. 1.8678 -1.0470 -1.0235 H 0 0 0 0 0 0 0 0 0 0 0 0
  15978. 1 2 2 0
  15979. 2 3 1 0
  15980. 3 4 2 0
  15981. 4 5 1 0
  15982. 5 6 2 0
  15983. 6 1 1 0
  15984. 1 7 1 0
  15985. 2 8 1 0
  15986. 3 9 1 0
  15987. 5 10 1 0
  15988. 6 11 1 0
  15989. M END
  15990. $$$$
  15991. RDKit 3D
  15992. 11 11 0 0 0 0 0 0 0 0999 V2000
  15993. -0.2702 -0.8292 -0.8006 C 0 0 0 0 0 0 0 0 0 0 0 0
  15994. -1.2785 -0.1471 -0.1278 C 0 0 0 0 0 0 0 0 0 0 0 0
  15995. -0.9129 0.8149 0.8003 C 0 0 0 0 0 0 0 0 0 0 0 0
  15996. 0.3682 1.1300 1.0910 N 0 0 0 0 0 0 0 0 0 0 0 0
  15997. 1.3253 0.4510 0.4219 C 0 0 0 0 0 0 0 0 0 0 0 0
  15998. 1.0589 -0.5270 -0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0
  15999. -0.5180 -1.5900 -1.5351 H 0 0 0 0 0 0 0 0 0 0 0 0
  16000. -2.3238 -0.3592 -0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0
  16001. -1.6631 1.3745 1.3514 H 0 0 0 0 0 0 0 0 0 0 0 0
  16002. 2.3464 0.7227 0.6734 H 0 0 0 0 0 0 0 0 0 0 0 0
  16003. 1.8678 -1.0405 -1.0301 H 0 0 0 0 0 0 0 0 0 0 0 0
  16004. 1 2 2 0
  16005. 2 3 1 0
  16006. 3 4 2 0
  16007. 4 5 1 0
  16008. 5 6 2 0
  16009. 6 1 1 0
  16010. 1 7 1 0
  16011. 2 8 1 0
  16012. 3 9 1 0
  16013. 5 10 1 0
  16014. 6 11 1 0
  16015. M END
  16016. $$$$
  16017. RDKit 3D
  16018. 11 11 0 0 0 0 0 0 0 0999 V2000
  16019. -0.2702 -0.8242 -0.8058 C 0 0 0 0 0 0 0 0 0 0 0 0
  16020. -1.2785 -0.1463 -0.1287 C 0 0 0 0 0 0 0 0 0 0 0 0
  16021. -0.9129 0.8098 0.8054 C 0 0 0 0 0 0 0 0 0 0 0 0
  16022. 0.3682 1.1231 1.0981 N 0 0 0 0 0 0 0 0 0 0 0 0
  16023. 1.3253 0.4484 0.4247 C 0 0 0 0 0 0 0 0 0 0 0 0
  16024. 1.0589 -0.5238 -0.5264 C 0 0 0 0 0 0 0 0 0 0 0 0
  16025. -0.5180 -1.5803 -1.5451 H 0 0 0 0 0 0 0 0 0 0 0 0
  16026. -2.3238 -0.3571 -0.3236 H 0 0 0 0 0 0 0 0 0 0 0 0
  16027. -1.6631 1.3659 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
  16028. 2.3464 0.7184 0.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
  16029. 1.8678 -1.0340 -1.0366 H 0 0 0 0 0 0 0 0 0 0 0 0
  16030. 1 2 2 0
  16031. 2 3 1 0
  16032. 3 4 2 0
  16033. 4 5 1 0
  16034. 5 6 2 0
  16035. 6 1 1 0
  16036. 1 7 1 0
  16037. 2 8 1 0
  16038. 3 9 1 0
  16039. 5 10 1 0
  16040. 6 11 1 0
  16041. M END
  16042. $$$$
  16043. RDKit 3D
  16044. 11 11 0 0 0 0 0 0 0 0999 V2000
  16045. -0.2702 -0.8191 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0
  16046. -1.2785 -0.1455 -0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  16047. -0.9129 0.8047 0.8105 C 0 0 0 0 0 0 0 0 0 0 0 0
  16048. 0.3682 1.1162 1.1051 N 0 0 0 0 0 0 0 0 0 0 0 0
  16049. 1.3253 0.4457 0.4275 C 0 0 0 0 0 0 0 0 0 0 0 0
  16050. 1.0589 -0.5204 -0.5296 C 0 0 0 0 0 0 0 0 0 0 0 0
  16051. -0.5180 -1.5706 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0
  16052. -2.3238 -0.3551 -0.3258 H 0 0 0 0 0 0 0 0 0 0 0 0
  16053. -1.6631 1.3574 1.3686 H 0 0 0 0 0 0 0 0 0 0 0 0
  16054. 2.3464 0.7142 0.6824 H 0 0 0 0 0 0 0 0 0 0 0 0
  16055. 1.8678 -1.0275 -1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0
  16056. 1 2 2 0
  16057. 2 3 1 0
  16058. 3 4 2 0
  16059. 4 5 1 0
  16060. 5 6 2 0
  16061. 6 1 1 0
  16062. 1 7 1 0
  16063. 2 8 1 0
  16064. 3 9 1 0
  16065. 5 10 1 0
  16066. 6 11 1 0
  16067. M END
  16068. $$$$
  16069. RDKit 3D
  16070. 11 11 0 0 0 0 0 0 0 0999 V2000
  16071. -0.2702 -0.8140 -0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0
  16072. -1.2785 -0.1446 -0.1306 C 0 0 0 0 0 0 0 0 0 0 0 0
  16073. -0.9129 0.7996 0.8155 C 0 0 0 0 0 0 0 0 0 0 0 0
  16074. 0.3682 1.1092 1.1121 N 0 0 0 0 0 0 0 0 0 0 0 0
  16075. 1.3253 0.4430 0.4303 C 0 0 0 0 0 0 0 0 0 0 0 0
  16076. 1.0589 -0.5171 -0.5329 C 0 0 0 0 0 0 0 0 0 0 0 0
  16077. -0.5180 -1.5608 -1.5648 H 0 0 0 0 0 0 0 0 0 0 0 0
  16078. -2.3238 -0.3530 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0
  16079. -1.6631 1.3487 1.3771 H 0 0 0 0 0 0 0 0 0 0 0 0
  16080. 2.3464 0.7099 0.6869 H 0 0 0 0 0 0 0 0 0 0 0 0
  16081. 1.8678 -1.0209 -1.0495 H 0 0 0 0 0 0 0 0 0 0 0 0
  16082. 1 2 2 0
  16083. 2 3 1 0
  16084. 3 4 2 0
  16085. 4 5 1 0
  16086. 5 6 2 0
  16087. 6 1 1 0
  16088. 1 7 1 0
  16089. 2 8 1 0
  16090. 3 9 1 0
  16091. 5 10 1 0
  16092. 6 11 1 0
  16093. M END
  16094. $$$$
  16095. RDKit 3D
  16096. 11 11 0 0 0 0 0 0 0 0999 V2000
  16097. -0.2702 -0.8088 -0.8212 C 0 0 0 0 0 0 0 0 0 0 0 0
  16098. -1.2785 -0.1438 -0.1315 C 0 0 0 0 0 0 0 0 0 0 0 0
  16099. -0.9129 0.7945 0.8206 C 0 0 0 0 0 0 0 0 0 0 0 0
  16100. 0.3682 1.1022 1.1191 N 0 0 0 0 0 0 0 0 0 0 0 0
  16101. 1.3253 0.4403 0.4331 C 0 0 0 0 0 0 0 0 0 0 0 0
  16102. 1.0589 -0.5137 -0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0
  16103. -0.5180 -1.5509 -1.5746 H 0 0 0 0 0 0 0 0 0 0 0 0
  16104. -2.3238 -0.3510 -0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0
  16105. -1.6631 1.3401 1.3855 H 0 0 0 0 0 0 0 0 0 0 0 0
  16106. 2.3464 0.7055 0.6913 H 0 0 0 0 0 0 0 0 0 0 0 0
  16107. 1.8678 -1.0143 -1.0559 H 0 0 0 0 0 0 0 0 0 0 0 0
  16108. 1 2 2 0
  16109. 2 3 1 0
  16110. 3 4 2 0
  16111. 4 5 1 0
  16112. 5 6 2 0
  16113. 6 1 1 0
  16114. 1 7 1 0
  16115. 2 8 1 0
  16116. 3 9 1 0
  16117. 5 10 1 0
  16118. 6 11 1 0
  16119. M END
  16120. $$$$
  16121. RDKit 3D
  16122. 11 11 0 0 0 0 0 0 0 0999 V2000
  16123. -0.2702 -0.8037 -0.8263 C 0 0 0 0 0 0 0 0 0 0 0 0
  16124. -1.2785 -0.1430 -0.1324 C 0 0 0 0 0 0 0 0 0 0 0 0
  16125. -0.9129 0.7893 0.8255 C 0 0 0 0 0 0 0 0 0 0 0 0
  16126. 0.3682 1.0952 1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0
  16127. 1.3253 0.4375 0.4358 C 0 0 0 0 0 0 0 0 0 0 0 0
  16128. 1.0589 -0.5104 -0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0
  16129. -0.5180 -1.5410 -1.5843 H 0 0 0 0 0 0 0 0 0 0 0 0
  16130. -2.3238 -0.3489 -0.3324 H 0 0 0 0 0 0 0 0 0 0 0 0
  16131. -1.6631 1.3313 1.3939 H 0 0 0 0 0 0 0 0 0 0 0 0
  16132. 2.3464 0.7012 0.6958 H 0 0 0 0 0 0 0 0 0 0 0 0
  16133. 1.8678 -1.0077 -1.0623 H 0 0 0 0 0 0 0 0 0 0 0 0
  16134. 1 2 2 0
  16135. 2 3 1 0
  16136. 3 4 2 0
  16137. 4 5 1 0
  16138. 5 6 2 0
  16139. 6 1 1 0
  16140. 1 7 1 0
  16141. 2 8 1 0
  16142. 3 9 1 0
  16143. 5 10 1 0
  16144. 6 11 1 0
  16145. M END
  16146. $$$$
  16147. RDKit 3D
  16148. 11 11 0 0 0 0 0 0 0 0999 V2000
  16149. -0.2702 -0.7985 -0.8313 C 0 0 0 0 0 0 0 0 0 0 0 0
  16150. -1.2785 -0.1422 -0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
  16151. -0.9129 0.7841 0.8305 C 0 0 0 0 0 0 0 0 0 0 0 0
  16152. 0.3682 1.0881 1.1328 N 0 0 0 0 0 0 0 0 0 0 0 0
  16153. 1.3253 0.4348 0.4386 C 0 0 0 0 0 0 0 0 0 0 0 0
  16154. 1.0589 -0.5070 -0.5425 C 0 0 0 0 0 0 0 0 0 0 0 0
  16155. -0.5180 -1.5310 -1.5939 H 0 0 0 0 0 0 0 0 0 0 0 0
  16156. -2.3238 -0.3468 -0.3346 H 0 0 0 0 0 0 0 0 0 0 0 0
  16157. -1.6631 1.3226 1.4022 H 0 0 0 0 0 0 0 0 0 0 0 0
  16158. 2.3464 0.6968 0.7002 H 0 0 0 0 0 0 0 0 0 0 0 0
  16159. 1.8678 -1.0010 -1.0686 H 0 0 0 0 0 0 0 0 0 0 0 0
  16160. 1 2 2 0
  16161. 2 3 1 0
  16162. 3 4 2 0
  16163. 4 5 1 0
  16164. 5 6 2 0
  16165. 6 1 1 0
  16166. 1 7 1 0
  16167. 2 8 1 0
  16168. 3 9 1 0
  16169. 5 10 1 0
  16170. 6 11 1 0
  16171. M END
  16172. $$$$
  16173. RDKit 3D
  16174. 11 11 0 0 0 0 0 0 0 0999 V2000
  16175. -0.2702 -0.7932 -0.8363 C 0 0 0 0 0 0 0 0 0 0 0 0
  16176. -1.2785 -0.1413 -0.1342 C 0 0 0 0 0 0 0 0 0 0 0 0
  16177. -0.9129 0.7789 0.8354 C 0 0 0 0 0 0 0 0 0 0 0 0
  16178. 0.3682 1.0809 1.1396 N 0 0 0 0 0 0 0 0 0 0 0 0
  16179. 1.3253 0.4320 0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0
  16180. 1.0589 -0.5035 -0.5457 C 0 0 0 0 0 0 0 0 0 0 0 0
  16181. -0.5180 -1.5209 -1.6035 H 0 0 0 0 0 0 0 0 0 0 0 0
  16182. -2.3238 -0.3447 -0.3368 H 0 0 0 0 0 0 0 0 0 0 0 0
  16183. -1.6631 1.3137 1.4105 H 0 0 0 0 0 0 0 0 0 0 0 0
  16184. 2.3464 0.6924 0.7045 H 0 0 0 0 0 0 0 0 0 0 0 0
  16185. 1.8678 -0.9942 -1.0748 H 0 0 0 0 0 0 0 0 0 0 0 0
  16186. 1 2 2 0
  16187. 2 3 1 0
  16188. 3 4 2 0
  16189. 4 5 1 0
  16190. 5 6 2 0
  16191. 6 1 1 0
  16192. 1 7 1 0
  16193. 2 8 1 0
  16194. 3 9 1 0
  16195. 5 10 1 0
  16196. 6 11 1 0
  16197. M END
  16198. $$$$
  16199. RDKit 3D
  16200. 11 11 0 0 0 0 0 0 0 0999 V2000
  16201. -0.2702 -0.7879 -0.8413 C 0 0 0 0 0 0 0 0 0 0 0 0
  16202. -1.2785 -0.1405 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  16203. -0.9129 0.7736 0.8403 C 0 0 0 0 0 0 0 0 0 0 0 0
  16204. 0.3682 1.0738 1.1464 N 0 0 0 0 0 0 0 0 0 0 0 0
  16205. 1.3253 0.4292 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0
  16206. 1.0589 -0.5001 -0.5489 C 0 0 0 0 0 0 0 0 0 0 0 0
  16207. -0.5180 -1.5108 -1.6131 H 0 0 0 0 0 0 0 0 0 0 0 0
  16208. -2.3238 -0.3426 -0.3389 H 0 0 0 0 0 0 0 0 0 0 0 0
  16209. -1.6631 1.3048 1.4187 H 0 0 0 0 0 0 0 0 0 0 0 0
  16210. 2.3464 0.6879 0.7089 H 0 0 0 0 0 0 0 0 0 0 0 0
  16211. 1.8678 -0.9875 -1.0811 H 0 0 0 0 0 0 0 0 0 0 0 0
  16212. 1 2 2 0
  16213. 2 3 1 0
  16214. 3 4 2 0
  16215. 4 5 1 0
  16216. 5 6 2 0
  16217. 6 1 1 0
  16218. 1 7 1 0
  16219. 2 8 1 0
  16220. 3 9 1 0
  16221. 5 10 1 0
  16222. 6 11 1 0
  16223. M END
  16224. $$$$
  16225. RDKit 3D
  16226. 11 11 0 0 0 0 0 0 0 0999 V2000
  16227. -0.2702 -0.7826 -0.8462 C 0 0 0 0 0 0 0 0 0 0 0 0
  16228. -1.2785 -0.1396 -0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
  16229. -0.9129 0.7683 0.8451 C 0 0 0 0 0 0 0 0 0 0 0 0
  16230. 0.3682 1.0665 1.1531 N 0 0 0 0 0 0 0 0 0 0 0 0
  16231. 1.3253 0.4265 0.4467 C 0 0 0 0 0 0 0 0 0 0 0 0
  16232. 1.0589 -0.4966 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0
  16233. -0.5180 -1.5007 -1.6225 H 0 0 0 0 0 0 0 0 0 0 0 0
  16234. -2.3238 -0.3404 -0.3411 H 0 0 0 0 0 0 0 0 0 0 0 0
  16235. -1.6631 1.2959 1.4269 H 0 0 0 0 0 0 0 0 0 0 0 0
  16236. 2.3464 0.6835 0.7132 H 0 0 0 0 0 0 0 0 0 0 0 0
  16237. 1.8678 -0.9807 -1.0872 H 0 0 0 0 0 0 0 0 0 0 0 0
  16238. 1 2 2 0
  16239. 2 3 1 0
  16240. 3 4 2 0
  16241. 4 5 1 0
  16242. 5 6 2 0
  16243. 6 1 1 0
  16244. 1 7 1 0
  16245. 2 8 1 0
  16246. 3 9 1 0
  16247. 5 10 1 0
  16248. 6 11 1 0
  16249. M END
  16250. $$$$
  16251. RDKit 3D
  16252. 11 11 0 0 0 0 0 0 0 0999 V2000
  16253. -0.2702 -0.7773 -0.8511 C 0 0 0 0 0 0 0 0 0 0 0 0
  16254. -1.2785 -0.1388 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0
  16255. -0.9129 0.7630 0.8499 C 0 0 0 0 0 0 0 0 0 0 0 0
  16256. 0.3682 1.0593 1.1598 N 0 0 0 0 0 0 0 0 0 0 0 0
  16257. 1.3253 0.4236 0.4493 C 0 0 0 0 0 0 0 0 0 0 0 0
  16258. 1.0589 -0.4932 -0.5551 C 0 0 0 0 0 0 0 0 0 0 0 0
  16259. -0.5180 -1.4904 -1.6319 H 0 0 0 0 0 0 0 0 0 0 0 0
  16260. -2.3238 -0.3383 -0.3432 H 0 0 0 0 0 0 0 0 0 0 0 0
  16261. -1.6631 1.2869 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  16262. 2.3464 0.6790 0.7174 H 0 0 0 0 0 0 0 0 0 0 0 0
  16263. 1.8678 -0.9738 -1.0934 H 0 0 0 0 0 0 0 0 0 0 0 0
  16264. 1 2 2 0
  16265. 2 3 1 0
  16266. 3 4 2 0
  16267. 4 5 1 0
  16268. 5 6 2 0
  16269. 6 1 1 0
  16270. 1 7 1 0
  16271. 2 8 1 0
  16272. 3 9 1 0
  16273. 5 10 1 0
  16274. 6 11 1 0
  16275. M END
  16276. $$$$
  16277. RDKit 3D
  16278. 11 11 0 0 0 0 0 0 0 0999 V2000
  16279. -0.2702 -0.7719 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0
  16280. -1.2785 -0.1379 -0.1377 C 0 0 0 0 0 0 0 0 0 0 0 0
  16281. -0.9129 0.7576 0.8547 C 0 0 0 0 0 0 0 0 0 0 0 0
  16282. 0.3682 1.0520 1.1664 N 0 0 0 0 0 0 0 0 0 0 0 0
  16283. 1.3253 0.4208 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0
  16284. 1.0589 -0.4897 -0.5582 C 0 0 0 0 0 0 0 0 0 0 0 0
  16285. -0.5180 -1.4802 -1.6412 H 0 0 0 0 0 0 0 0 0 0 0 0
  16286. -2.3238 -0.3361 -0.3453 H 0 0 0 0 0 0 0 0 0 0 0 0
  16287. -1.6631 1.2779 1.4431 H 0 0 0 0 0 0 0 0 0 0 0 0
  16288. 2.3464 0.6744 0.7217 H 0 0 0 0 0 0 0 0 0 0 0 0
  16289. 1.8678 -0.9669 -1.0995 H 0 0 0 0 0 0 0 0 0 0 0 0
  16290. 1 2 2 0
  16291. 2 3 1 0
  16292. 3 4 2 0
  16293. 4 5 1 0
  16294. 5 6 2 0
  16295. 6 1 1 0
  16296. 1 7 1 0
  16297. 2 8 1 0
  16298. 3 9 1 0
  16299. 5 10 1 0
  16300. 6 11 1 0
  16301. M END
  16302. $$$$
  16303. RDKit 3D
  16304. 11 11 0 0 0 0 0 0 0 0999 V2000
  16305. -0.2702 -0.7666 -0.8608 C 0 0 0 0 0 0 0 0 0 0 0 0
  16306. -1.2785 -0.1370 -0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0
  16307. -0.9129 0.7523 0.8594 C 0 0 0 0 0 0 0 0 0 0 0 0
  16308. 0.3682 1.0446 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0
  16309. 1.3253 0.4180 0.4546 C 0 0 0 0 0 0 0 0 0 0 0 0
  16310. 1.0589 -0.4862 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0
  16311. -0.5180 -1.4698 -1.6505 H 0 0 0 0 0 0 0 0 0 0 0 0
  16312. -2.3238 -0.3339 -0.3474 H 0 0 0 0 0 0 0 0 0 0 0 0
  16313. -1.6631 1.2688 1.4511 H 0 0 0 0 0 0 0 0 0 0 0 0
  16314. 2.3464 0.6699 0.7259 H 0 0 0 0 0 0 0 0 0 0 0 0
  16315. 1.8678 -0.9600 -1.1055 H 0 0 0 0 0 0 0 0 0 0 0 0
  16316. 1 2 2 0
  16317. 2 3 1 0
  16318. 3 4 2 0
  16319. 4 5 1 0
  16320. 5 6 2 0
  16321. 6 1 1 0
  16322. 1 7 1 0
  16323. 2 8 1 0
  16324. 3 9 1 0
  16325. 5 10 1 0
  16326. 6 11 1 0
  16327. M END
  16328. $$$$
  16329. RDKit 3D
  16330. 11 11 0 0 0 0 0 0 0 0999 V2000
  16331. -0.2702 -0.7611 -0.8656 C 0 0 0 0 0 0 0 0 0 0 0 0
  16332. -1.2785 -0.1362 -0.1394 C 0 0 0 0 0 0 0 0 0 0 0 0
  16333. -0.9129 0.7468 0.8641 C 0 0 0 0 0 0 0 0 0 0 0 0
  16334. 0.3682 1.0372 1.1796 N 0 0 0 0 0 0 0 0 0 0 0 0
  16335. 1.3253 0.4151 0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0
  16336. 1.0589 -0.4826 -0.5643 C 0 0 0 0 0 0 0 0 0 0 0 0
  16337. -0.5180 -1.4594 -1.6597 H 0 0 0 0 0 0 0 0 0 0 0 0
  16338. -2.3238 -0.3317 -0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0
  16339. -1.6631 1.2596 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0
  16340. 2.3464 0.6653 0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0
  16341. 1.8678 -0.9530 -1.1115 H 0 0 0 0 0 0 0 0 0 0 0 0
  16342. 1 2 2 0
  16343. 2 3 1 0
  16344. 3 4 2 0
  16345. 4 5 1 0
  16346. 5 6 2 0
  16347. 6 1 1 0
  16348. 1 7 1 0
  16349. 2 8 1 0
  16350. 3 9 1 0
  16351. 5 10 1 0
  16352. 6 11 1 0
  16353. M END
  16354. $$$$
  16355. RDKit 3D
  16356. 11 11 0 0 0 0 0 0 0 0999 V2000
  16357. -0.2702 -0.7557 -0.8704 C 0 0 0 0 0 0 0 0 0 0 0 0
  16358. -1.2785 -0.1353 -0.1402 C 0 0 0 0 0 0 0 0 0 0 0 0
  16359. -0.9129 0.7414 0.8688 C 0 0 0 0 0 0 0 0 0 0 0 0
  16360. 0.3682 1.0298 1.1861 N 0 0 0 0 0 0 0 0 0 0 0 0
  16361. 1.3253 0.4122 0.4599 C 0 0 0 0 0 0 0 0 0 0 0 0
  16362. 1.0589 -0.4791 -0.5673 C 0 0 0 0 0 0 0 0 0 0 0 0
  16363. -0.5180 -1.4490 -1.6689 H 0 0 0 0 0 0 0 0 0 0 0 0
  16364. -2.3238 -0.3295 -0.3516 H 0 0 0 0 0 0 0 0 0 0 0 0
  16365. -1.6631 1.2504 1.4669 H 0 0 0 0 0 0 0 0 0 0 0 0
  16366. 2.3464 0.6607 0.7343 H 0 0 0 0 0 0 0 0 0 0 0 0
  16367. 1.8678 -0.9460 -1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0
  16368. 1 2 2 0
  16369. 2 3 1 0
  16370. 3 4 2 0
  16371. 4 5 1 0
  16372. 5 6 2 0
  16373. 6 1 1 0
  16374. 1 7 1 0
  16375. 2 8 1 0
  16376. 3 9 1 0
  16377. 5 10 1 0
  16378. 6 11 1 0
  16379. M END
  16380. $$$$
  16381. RDKit 3D
  16382. 11 11 0 0 0 0 0 0 0 0999 V2000
  16383. -0.2702 -0.7502 -0.8751 C 0 0 0 0 0 0 0 0 0 0 0 0
  16384. -1.2785 -0.1344 -0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0
  16385. -0.9129 0.7359 0.8735 C 0 0 0 0 0 0 0 0 0 0 0 0
  16386. 0.3682 1.0223 1.1925 N 0 0 0 0 0 0 0 0 0 0 0 0
  16387. 1.3253 0.4093 0.4624 C 0 0 0 0 0 0 0 0 0 0 0 0
  16388. 1.0589 -0.4755 -0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0
  16389. -0.5180 -1.4384 -1.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
  16390. -2.3238 -0.3273 -0.3537 H 0 0 0 0 0 0 0 0 0 0 0 0
  16391. -1.6631 1.2412 1.4747 H 0 0 0 0 0 0 0 0 0 0 0 0
  16392. 2.3464 0.6561 0.7384 H 0 0 0 0 0 0 0 0 0 0 0 0
  16393. 1.8678 -0.9390 -1.1234 H 0 0 0 0 0 0 0 0 0 0 0 0
  16394. 1 2 2 0
  16395. 2 3 1 0
  16396. 3 4 2 0
  16397. 4 5 1 0
  16398. 5 6 2 0
  16399. 6 1 1 0
  16400. 1 7 1 0
  16401. 2 8 1 0
  16402. 3 9 1 0
  16403. 5 10 1 0
  16404. 6 11 1 0
  16405. M END
  16406. $$$$
  16407. RDKit 3D
  16408. 11 11 0 0 0 0 0 0 0 0999 V2000
  16409. -0.2702 -0.7447 -0.8798 C 0 0 0 0 0 0 0 0 0 0 0 0
  16410. -1.2785 -0.1335 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  16411. -0.9129 0.7304 0.8781 C 0 0 0 0 0 0 0 0 0 0 0 0
  16412. 0.3682 1.0148 1.1989 N 0 0 0 0 0 0 0 0 0 0 0 0
  16413. 1.3253 0.4064 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0
  16414. 1.0589 -0.4719 -0.5733 C 0 0 0 0 0 0 0 0 0 0 0 0
  16415. -0.5180 -1.4279 -1.6869 H 0 0 0 0 0 0 0 0 0 0 0 0
  16416. -2.3238 -0.3251 -0.3557 H 0 0 0 0 0 0 0 0 0 0 0 0
  16417. -1.6631 1.2319 1.4825 H 0 0 0 0 0 0 0 0 0 0 0 0
  16418. 2.3464 0.6514 0.7425 H 0 0 0 0 0 0 0 0 0 0 0 0
  16419. 1.8678 -0.9319 -1.1293 H 0 0 0 0 0 0 0 0 0 0 0 0
  16420. 1 2 2 0
  16421. 2 3 1 0
  16422. 3 4 2 0
  16423. 4 5 1 0
  16424. 5 6 2 0
  16425. 6 1 1 0
  16426. 1 7 1 0
  16427. 2 8 1 0
  16428. 3 9 1 0
  16429. 5 10 1 0
  16430. 6 11 1 0
  16431. M END
  16432. $$$$
  16433. RDKit 3D
  16434. 11 11 0 0 0 0 0 0 0 0999 V2000
  16435. -0.2702 -0.7391 -0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0
  16436. -1.2785 -0.1326 -0.1428 C 0 0 0 0 0 0 0 0 0 0 0 0
  16437. -0.9129 0.7249 0.8826 C 0 0 0 0 0 0 0 0 0 0 0 0
  16438. 0.3682 1.0072 1.2053 N 0 0 0 0 0 0 0 0 0 0 0 0
  16439. 1.3253 0.4035 0.4675 C 0 0 0 0 0 0 0 0 0 0 0 0
  16440. 1.0589 -0.4683 -0.5763 C 0 0 0 0 0 0 0 0 0 0 0 0
  16441. -0.5180 -1.4173 -1.6959 H 0 0 0 0 0 0 0 0 0 0 0 0
  16442. -2.3238 -0.3228 -0.3578 H 0 0 0 0 0 0 0 0 0 0 0 0
  16443. -1.6631 1.2226 1.4902 H 0 0 0 0 0 0 0 0 0 0 0 0
  16444. 2.3464 0.6468 0.7466 H 0 0 0 0 0 0 0 0 0 0 0 0
  16445. 1.8678 -0.9248 -1.1351 H 0 0 0 0 0 0 0 0 0 0 0 0
  16446. 1 2 2 0
  16447. 2 3 1 0
  16448. 3 4 2 0
  16449. 4 5 1 0
  16450. 5 6 2 0
  16451. 6 1 1 0
  16452. 1 7 1 0
  16453. 2 8 1 0
  16454. 3 9 1 0
  16455. 5 10 1 0
  16456. 6 11 1 0
  16457. M END
  16458. $$$$
  16459. RDKit 3D
  16460. 11 11 0 0 0 0 0 0 0 0999 V2000
  16461. -0.2702 -0.7336 -0.8891 C 0 0 0 0 0 0 0 0 0 0 0 0
  16462. -1.2785 -0.1317 -0.1436 C 0 0 0 0 0 0 0 0 0 0 0 0
  16463. -0.9129 0.7193 0.8872 C 0 0 0 0 0 0 0 0 0 0 0 0
  16464. 0.3682 0.9997 1.2116 N 0 0 0 0 0 0 0 0 0 0 0 0
  16465. 1.3253 0.4005 0.4701 C 0 0 0 0 0 0 0 0 0 0 0 0
  16466. 1.0589 -0.4647 -0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0
  16467. -0.5180 -1.4066 -1.7047 H 0 0 0 0 0 0 0 0 0 0 0 0
  16468. -2.3238 -0.3206 -0.3598 H 0 0 0 0 0 0 0 0 0 0 0 0
  16469. -1.6631 1.2132 1.4979 H 0 0 0 0 0 0 0 0 0 0 0 0
  16470. 2.3464 0.6421 0.7506 H 0 0 0 0 0 0 0 0 0 0 0 0
  16471. 1.8678 -0.9176 -1.1409 H 0 0 0 0 0 0 0 0 0 0 0 0
  16472. 1 2 2 0
  16473. 2 3 1 0
  16474. 3 4 2 0
  16475. 4 5 1 0
  16476. 5 6 2 0
  16477. 6 1 1 0
  16478. 1 7 1 0
  16479. 2 8 1 0
  16480. 3 9 1 0
  16481. 5 10 1 0
  16482. 6 11 1 0
  16483. M END
  16484. $$$$
  16485. RDKit 3D
  16486. 11 11 0 0 0 0 0 0 0 0999 V2000
  16487. -0.2702 -0.7280 -0.8937 C 0 0 0 0 0 0 0 0 0 0 0 0
  16488. -1.2785 -0.1308 -0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
  16489. -0.9129 0.7137 0.8917 C 0 0 0 0 0 0 0 0 0 0 0 0
  16490. 0.3682 0.9920 1.2178 N 0 0 0 0 0 0 0 0 0 0 0 0
  16491. 1.3253 0.3976 0.4726 C 0 0 0 0 0 0 0 0 0 0 0 0
  16492. 1.0589 -0.4610 -0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0
  16493. -0.5180 -1.3958 -1.7135 H 0 0 0 0 0 0 0 0 0 0 0 0
  16494. -2.3238 -0.3183 -0.3618 H 0 0 0 0 0 0 0 0 0 0 0 0
  16495. -1.6631 1.2037 1.5055 H 0 0 0 0 0 0 0 0 0 0 0 0
  16496. 2.3464 0.6373 0.7547 H 0 0 0 0 0 0 0 0 0 0 0 0
  16497. 1.8678 -0.9105 -1.1467 H 0 0 0 0 0 0 0 0 0 0 0 0
  16498. 1 2 2 0
  16499. 2 3 1 0
  16500. 3 4 2 0
  16501. 4 5 1 0
  16502. 5 6 2 0
  16503. 6 1 1 0
  16504. 1 7 1 0
  16505. 2 8 1 0
  16506. 3 9 1 0
  16507. 5 10 1 0
  16508. 6 11 1 0
  16509. M END
  16510. $$$$
  16511. RDKit 3D
  16512. 11 11 0 0 0 0 0 0 0 0999 V2000
  16513. -0.2702 -0.7223 -0.8982 C 0 0 0 0 0 0 0 0 0 0 0 0
  16514. -1.2785 -0.1299 -0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0
  16515. -0.9129 0.7081 0.8961 C 0 0 0 0 0 0 0 0 0 0 0 0
  16516. 0.3682 0.9843 1.2240 N 0 0 0 0 0 0 0 0 0 0 0 0
  16517. 1.3253 0.3946 0.4751 C 0 0 0 0 0 0 0 0 0 0 0 0
  16518. 1.0589 -0.4573 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0
  16519. -0.5180 -1.3850 -1.7223 H 0 0 0 0 0 0 0 0 0 0 0 0
  16520. -2.3238 -0.3160 -0.3638 H 0 0 0 0 0 0 0 0 0 0 0 0
  16521. -1.6631 1.1943 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0
  16522. 2.3464 0.6326 0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0
  16523. 1.8678 -0.9032 -1.1524 H 0 0 0 0 0 0 0 0 0 0 0 0
  16524. 1 2 2 0
  16525. 2 3 1 0
  16526. 3 4 2 0
  16527. 4 5 1 0
  16528. 5 6 2 0
  16529. 6 1 1 0
  16530. 1 7 1 0
  16531. 2 8 1 0
  16532. 3 9 1 0
  16533. 5 10 1 0
  16534. 6 11 1 0
  16535. M END
  16536. $$$$
  16537. RDKit 3D
  16538. 11 11 0 0 0 0 0 0 0 0999 V2000
  16539. -0.2702 -0.7167 -0.9027 C 0 0 0 0 0 0 0 0 0 0 0 0
  16540. -1.2785 -0.1290 -0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0
  16541. -0.9129 0.7025 0.9006 C 0 0 0 0 0 0 0 0 0 0 0 0
  16542. 0.3682 0.9766 1.2302 N 0 0 0 0 0 0 0 0 0 0 0 0
  16543. 1.3253 0.3916 0.4775 C 0 0 0 0 0 0 0 0 0 0 0 0
  16544. 1.0589 -0.4537 -0.5879 C 0 0 0 0 0 0 0 0 0 0 0 0
  16545. -0.5180 -1.3742 -1.7309 H 0 0 0 0 0 0 0 0 0 0 0 0
  16546. -2.3238 -0.3138 -0.3658 H 0 0 0 0 0 0 0 0 0 0 0 0
  16547. -1.6631 1.1847 1.5205 H 0 0 0 0 0 0 0 0 0 0 0 0
  16548. 2.3464 0.6278 0.7626 H 0 0 0 0 0 0 0 0 0 0 0 0
  16549. 1.8678 -0.8960 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0
  16550. 1 2 2 0
  16551. 2 3 1 0
  16552. 3 4 2 0
  16553. 4 5 1 0
  16554. 5 6 2 0
  16555. 6 1 1 0
  16556. 1 7 1 0
  16557. 2 8 1 0
  16558. 3 9 1 0
  16559. 5 10 1 0
  16560. 6 11 1 0
  16561. M END
  16562. $$$$
  16563. RDKit 3D
  16564. 11 11 0 0 0 0 0 0 0 0999 V2000
  16565. -0.2702 -0.7110 -0.9072 C 0 0 0 0 0 0 0 0 0 0 0 0
  16566. -1.2785 -0.1281 -0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0
  16567. -0.9129 0.6968 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0
  16568. 0.3682 0.9689 1.2363 N 0 0 0 0 0 0 0 0 0 0 0 0
  16569. 1.3253 0.3886 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0
  16570. 1.0589 -0.4500 -0.5907 C 0 0 0 0 0 0 0 0 0 0 0 0
  16571. -0.5180 -1.3633 -1.7395 H 0 0 0 0 0 0 0 0 0 0 0 0
  16572. -2.3238 -0.3115 -0.3677 H 0 0 0 0 0 0 0 0 0 0 0 0
  16573. -1.6631 1.1751 1.5279 H 0 0 0 0 0 0 0 0 0 0 0 0
  16574. 2.3464 0.6230 0.7665 H 0 0 0 0 0 0 0 0 0 0 0 0
  16575. 1.8678 -0.8887 -1.1636 H 0 0 0 0 0 0 0 0 0 0 0 0
  16576. 1 2 2 0
  16577. 2 3 1 0
  16578. 3 4 2 0
  16579. 4 5 1 0
  16580. 5 6 2 0
  16581. 6 1 1 0
  16582. 1 7 1 0
  16583. 2 8 1 0
  16584. 3 9 1 0
  16585. 5 10 1 0
  16586. 6 11 1 0
  16587. M END
  16588. $$$$
  16589. RDKit 3D
  16590. 11 11 0 0 0 0 0 0 0 0999 V2000
  16591. -0.2702 -0.7053 -0.9117 C 0 0 0 0 0 0 0 0 0 0 0 0
  16592. -1.2785 -0.1271 -0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0
  16593. -0.9129 0.6911 0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0
  16594. 0.3682 0.9611 1.2424 N 0 0 0 0 0 0 0 0 0 0 0 0
  16595. 1.3253 0.3856 0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0
  16596. 1.0589 -0.4462 -0.5935 C 0 0 0 0 0 0 0 0 0 0 0 0
  16597. -0.5180 -1.3523 -1.7481 H 0 0 0 0 0 0 0 0 0 0 0 0
  16598. -2.3238 -0.3091 -0.3697 H 0 0 0 0 0 0 0 0 0 0 0 0
  16599. -1.6631 1.1655 1.5352 H 0 0 0 0 0 0 0 0 0 0 0 0
  16600. 2.3464 0.6182 0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0
  16601. 1.8678 -0.8813 -1.1692 H 0 0 0 0 0 0 0 0 0 0 0 0
  16602. 1 2 2 0
  16603. 2 3 1 0
  16604. 3 4 2 0
  16605. 4 5 1 0
  16606. 5 6 2 0
  16607. 6 1 1 0
  16608. 1 7 1 0
  16609. 2 8 1 0
  16610. 3 9 1 0
  16611. 5 10 1 0
  16612. 6 11 1 0
  16613. M END
  16614. $$$$
  16615. RDKit 3D
  16616. 11 11 0 0 0 0 0 0 0 0999 V2000
  16617. -0.2702 -0.6995 -0.9161 C 0 0 0 0 0 0 0 0 0 0 0 0
  16618. -1.2785 -0.1262 -0.1485 C 0 0 0 0 0 0 0 0 0 0 0 0
  16619. -0.9129 0.6854 0.9137 C 0 0 0 0 0 0 0 0 0 0 0 0
  16620. 0.3682 0.9533 1.2484 N 0 0 0 0 0 0 0 0 0 0 0 0
  16621. 1.3253 0.3825 0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0
  16622. 1.0589 -0.4425 -0.5963 C 0 0 0 0 0 0 0 0 0 0 0 0
  16623. -0.5180 -1.3413 -1.7565 H 0 0 0 0 0 0 0 0 0 0 0 0
  16624. -2.3238 -0.3068 -0.3716 H 0 0 0 0 0 0 0 0 0 0 0 0
  16625. -1.6631 1.1559 1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0
  16626. 2.3464 0.6133 0.7743 H 0 0 0 0 0 0 0 0 0 0 0 0
  16627. 1.8678 -0.8740 -1.1747 H 0 0 0 0 0 0 0 0 0 0 0 0
  16628. 1 2 2 0
  16629. 2 3 1 0
  16630. 3 4 2 0
  16631. 4 5 1 0
  16632. 5 6 2 0
  16633. 6 1 1 0
  16634. 1 7 1 0
  16635. 2 8 1 0
  16636. 3 9 1 0
  16637. 5 10 1 0
  16638. 6 11 1 0
  16639. M END
  16640. $$$$
  16641. RDKit 3D
  16642. 11 11 0 0 0 0 0 0 0 0999 V2000
  16643. -0.2702 -0.6938 -0.9205 C 0 0 0 0 0 0 0 0 0 0 0 0
  16644. -1.2785 -0.1253 -0.1492 C 0 0 0 0 0 0 0 0 0 0 0 0
  16645. -0.9129 0.6796 0.9179 C 0 0 0 0 0 0 0 0 0 0 0 0
  16646. 0.3682 0.9454 1.2543 N 0 0 0 0 0 0 0 0 0 0 0 0
  16647. 1.3253 0.3795 0.4872 C 0 0 0 0 0 0 0 0 0 0 0 0
  16648. 1.0589 -0.4387 -0.5991 C 0 0 0 0 0 0 0 0 0 0 0 0
  16649. -0.5180 -1.3303 -1.7649 H 0 0 0 0 0 0 0 0 0 0 0 0
  16650. -2.3238 -0.3045 -0.3735 H 0 0 0 0 0 0 0 0 0 0 0 0
  16651. -1.6631 1.1461 1.5498 H 0 0 0 0 0 0 0 0 0 0 0 0
  16652. 2.3464 0.6084 0.7782 H 0 0 0 0 0 0 0 0 0 0 0 0
  16653. 1.8678 -0.8666 -1.1802 H 0 0 0 0 0 0 0 0 0 0 0 0
  16654. 1 2 2 0
  16655. 2 3 1 0
  16656. 3 4 2 0
  16657. 4 5 1 0
  16658. 5 6 2 0
  16659. 6 1 1 0
  16660. 1 7 1 0
  16661. 2 8 1 0
  16662. 3 9 1 0
  16663. 5 10 1 0
  16664. 6 11 1 0
  16665. M END
  16666. $$$$
  16667. RDKit 3D
  16668. 11 11 0 0 0 0 0 0 0 0999 V2000
  16669. -0.2702 -0.6880 -0.9248 C 0 0 0 0 0 0 0 0 0 0 0 0
  16670. -1.2785 -0.1243 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
  16671. -0.9129 0.6738 0.9222 C 0 0 0 0 0 0 0 0 0 0 0 0
  16672. 0.3682 0.9375 1.2603 N 0 0 0 0 0 0 0 0 0 0 0 0
  16673. 1.3253 0.3764 0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0
  16674. 1.0589 -0.4350 -0.6018 C 0 0 0 0 0 0 0 0 0 0 0 0
  16675. -0.5180 -1.3191 -1.7733 H 0 0 0 0 0 0 0 0 0 0 0 0
  16676. -2.3238 -0.3021 -0.3754 H 0 0 0 0 0 0 0 0 0 0 0 0
  16677. -1.6631 1.1364 1.5569 H 0 0 0 0 0 0 0 0 0 0 0 0
  16678. 2.3464 0.6035 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0
  16679. 1.8678 -0.8592 -1.1856 H 0 0 0 0 0 0 0 0 0 0 0 0
  16680. 1 2 2 0
  16681. 2 3 1 0
  16682. 3 4 2 0
  16683. 4 5 1 0
  16684. 5 6 2 0
  16685. 6 1 1 0
  16686. 1 7 1 0
  16687. 2 8 1 0
  16688. 3 9 1 0
  16689. 5 10 1 0
  16690. 6 11 1 0
  16691. M END
  16692. $$$$
  16693. RDKit 3D
  16694. 11 11 0 0 0 0 0 0 0 0999 V2000
  16695. -0.2702 -0.6821 -0.9291 C 0 0 0 0 0 0 0 0 0 0 0 0
  16696. -1.2785 -0.1234 -0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0
  16697. -0.9129 0.6680 0.9264 C 0 0 0 0 0 0 0 0 0 0 0 0
  16698. 0.3682 0.9296 1.2661 N 0 0 0 0 0 0 0 0 0 0 0 0
  16699. 1.3253 0.3733 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0
  16700. 1.0589 -0.4312 -0.6045 C 0 0 0 0 0 0 0 0 0 0 0 0
  16701. -0.5180 -1.3080 -1.7815 H 0 0 0 0 0 0 0 0 0 0 0 0
  16702. -2.3238 -0.2997 -0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0
  16703. -1.6631 1.1266 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0
  16704. 2.3464 0.5986 0.7857 H 0 0 0 0 0 0 0 0 0 0 0 0
  16705. 1.8678 -0.8517 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0
  16706. 1 2 2 0
  16707. 2 3 1 0
  16708. 3 4 2 0
  16709. 4 5 1 0
  16710. 5 6 2 0
  16711. 6 1 1 0
  16712. 1 7 1 0
  16713. 2 8 1 0
  16714. 3 9 1 0
  16715. 5 10 1 0
  16716. 6 11 1 0
  16717. M END
  16718. $$$$
  16719. RDKit 3D
  16720. 11 11 0 0 0 0 0 0 0 0999 V2000
  16721. -0.2702 -0.6763 -0.9334 C 0 0 0 0 0 0 0 0 0 0 0 0
  16722. -1.2785 -0.1224 -0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0
  16723. -0.9129 0.6622 0.9306 C 0 0 0 0 0 0 0 0 0 0 0 0
  16724. 0.3682 0.9216 1.2719 N 0 0 0 0 0 0 0 0 0 0 0 0
  16725. 1.3253 0.3702 0.4943 C 0 0 0 0 0 0 0 0 0 0 0 0
  16726. 1.0589 -0.4274 -0.6072 C 0 0 0 0 0 0 0 0 0 0 0 0
  16727. -0.5180 -1.2968 -1.7897 H 0 0 0 0 0 0 0 0 0 0 0 0
  16728. -2.3238 -0.2974 -0.3792 H 0 0 0 0 0 0 0 0 0 0 0 0
  16729. -1.6631 1.1167 1.5711 H 0 0 0 0 0 0 0 0 0 0 0 0
  16730. 2.3464 0.5937 0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0
  16731. 1.8678 -0.8442 -1.1963 H 0 0 0 0 0 0 0 0 0 0 0 0
  16732. 1 2 2 0
  16733. 2 3 1 0
  16734. 3 4 2 0
  16735. 4 5 1 0
  16736. 5 6 2 0
  16737. 6 1 1 0
  16738. 1 7 1 0
  16739. 2 8 1 0
  16740. 3 9 1 0
  16741. 5 10 1 0
  16742. 6 11 1 0
  16743. M END
  16744. $$$$
  16745. RDKit 3D
  16746. 11 11 0 0 0 0 0 0 0 0999 V2000
  16747. -0.2702 -0.6704 -0.9376 C 0 0 0 0 0 0 0 0 0 0 0 0
  16748. -1.2785 -0.1215 -0.1523 C 0 0 0 0 0 0 0 0 0 0 0 0
  16749. -0.9129 0.6563 0.9347 C 0 0 0 0 0 0 0 0 0 0 0 0
  16750. 0.3682 0.9136 1.2777 N 0 0 0 0 0 0 0 0 0 0 0 0
  16751. 1.3253 0.3671 0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0
  16752. 1.0589 -0.4235 -0.6099 C 0 0 0 0 0 0 0 0 0 0 0 0
  16753. -0.5180 -1.2855 -1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0
  16754. -2.3238 -0.2950 -0.3811 H 0 0 0 0 0 0 0 0 0 0 0 0
  16755. -1.6631 1.1068 1.5781 H 0 0 0 0 0 0 0 0 0 0 0 0
  16756. 2.3464 0.5887 0.7932 H 0 0 0 0 0 0 0 0 0 0 0 0
  16757. 1.8678 -0.8367 -1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0
  16758. 1 2 2 0
  16759. 2 3 1 0
  16760. 3 4 2 0
  16761. 4 5 1 0
  16762. 5 6 2 0
  16763. 6 1 1 0
  16764. 1 7 1 0
  16765. 2 8 1 0
  16766. 3 9 1 0
  16767. 5 10 1 0
  16768. 6 11 1 0
  16769. M END
  16770. $$$$
  16771. RDKit 3D
  16772. 11 11 0 0 0 0 0 0 0 0999 V2000
  16773. -0.2702 -0.6645 -0.9418 C 0 0 0 0 0 0 0 0 0 0 0 0
  16774. -1.2785 -0.1205 -0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0
  16775. -0.9129 0.6505 0.9388 C 0 0 0 0 0 0 0 0 0 0 0 0
  16776. 0.3682 0.9055 1.2834 N 0 0 0 0 0 0 0 0 0 0 0 0
  16777. 1.3253 0.3640 0.4989 C 0 0 0 0 0 0 0 0 0 0 0 0
  16778. 1.0589 -0.4197 -0.6126 C 0 0 0 0 0 0 0 0 0 0 0 0
  16779. -0.5180 -1.2742 -1.8058 H 0 0 0 0 0 0 0 0 0 0 0 0
  16780. -2.3238 -0.2926 -0.3829 H 0 0 0 0 0 0 0 0 0 0 0 0
  16781. -1.6631 1.0969 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0
  16782. 2.3464 0.5837 0.7969 H 0 0 0 0 0 0 0 0 0 0 0 0
  16783. 1.8678 -0.8291 -1.2068 H 0 0 0 0 0 0 0 0 0 0 0 0
  16784. 1 2 2 0
  16785. 2 3 1 0
  16786. 3 4 2 0
  16787. 4 5 1 0
  16788. 5 6 2 0
  16789. 6 1 1 0
  16790. 1 7 1 0
  16791. 2 8 1 0
  16792. 3 9 1 0
  16793. 5 10 1 0
  16794. 6 11 1 0
  16795. M END
  16796. $$$$
  16797. RDKit 3D
  16798. 11 11 0 0 0 0 0 0 0 0999 V2000
  16799. -0.2702 -0.6586 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0
  16800. -1.2785 -0.1196 -0.1539 C 0 0 0 0 0 0 0 0 0 0 0 0
  16801. -0.9129 0.6445 0.9429 C 0 0 0 0 0 0 0 0 0 0 0 0
  16802. 0.3682 0.8975 1.2891 N 0 0 0 0 0 0 0 0 0 0 0 0
  16803. 1.3253 0.3608 0.5012 C 0 0 0 0 0 0 0 0 0 0 0 0
  16804. 1.0589 -0.4158 -0.6152 C 0 0 0 0 0 0 0 0 0 0 0 0
  16805. -0.5180 -1.2628 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0
  16806. -2.3238 -0.2902 -0.3847 H 0 0 0 0 0 0 0 0 0 0 0 0
  16807. -1.6631 1.0869 1.5919 H 0 0 0 0 0 0 0 0 0 0 0 0
  16808. 2.3464 0.5787 0.8005 H 0 0 0 0 0 0 0 0 0 0 0 0
  16809. 1.8678 -0.8215 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  16810. 1 2 2 0
  16811. 2 3 1 0
  16812. 3 4 2 0
  16813. 4 5 1 0
  16814. 5 6 2 0
  16815. 6 1 1 0
  16816. 1 7 1 0
  16817. 2 8 1 0
  16818. 3 9 1 0
  16819. 5 10 1 0
  16820. 6 11 1 0
  16821. M END
  16822. $$$$
  16823. RDKit 3D
  16824. 11 11 0 0 0 0 0 0 0 0999 V2000
  16825. -0.2702 -0.6526 -0.9501 C 0 0 0 0 0 0 0 0 0 0 0 0
  16826. -1.2785 -0.1186 -0.1546 C 0 0 0 0 0 0 0 0 0 0 0 0
  16827. -0.9129 0.6386 0.9469 C 0 0 0 0 0 0 0 0 0 0 0 0
  16828. 0.3682 0.8893 1.2947 N 0 0 0 0 0 0 0 0 0 0 0 0
  16829. 1.3253 0.3577 0.5034 C 0 0 0 0 0 0 0 0 0 0 0 0
  16830. 1.0589 -0.4120 -0.6178 C 0 0 0 0 0 0 0 0 0 0 0 0
  16831. -0.5180 -1.2514 -1.8217 H 0 0 0 0 0 0 0 0 0 0 0 0
  16832. -2.3238 -0.2877 -0.3866 H 0 0 0 0 0 0 0 0 0 0 0 0
  16833. -1.6631 1.0769 1.5987 H 0 0 0 0 0 0 0 0 0 0 0 0
  16834. 2.3464 0.5736 0.8042 H 0 0 0 0 0 0 0 0 0 0 0 0
  16835. 1.8678 -0.8139 -1.2171 H 0 0 0 0 0 0 0 0 0 0 0 0
  16836. 1 2 2 0
  16837. 2 3 1 0
  16838. 3 4 2 0
  16839. 4 5 1 0
  16840. 5 6 2 0
  16841. 6 1 1 0
  16842. 1 7 1 0
  16843. 2 8 1 0
  16844. 3 9 1 0
  16845. 5 10 1 0
  16846. 6 11 1 0
  16847. M END
  16848. $$$$
  16849. RDKit 3D
  16850. 11 11 0 0 0 0 0 0 0 0999 V2000
  16851. -0.2702 -0.6466 -0.9542 C 0 0 0 0 0 0 0 0 0 0 0 0
  16852. -1.2785 -0.1176 -0.1554 C 0 0 0 0 0 0 0 0 0 0 0 0
  16853. -0.9129 0.6326 0.9509 C 0 0 0 0 0 0 0 0 0 0 0 0
  16854. 0.3682 0.8812 1.3003 N 0 0 0 0 0 0 0 0 0 0 0 0
  16855. 1.3253 0.3545 0.5057 C 0 0 0 0 0 0 0 0 0 0 0 0
  16856. 1.0589 -0.4081 -0.6204 C 0 0 0 0 0 0 0 0 0 0 0 0
  16857. -0.5180 -1.2399 -1.8295 H 0 0 0 0 0 0 0 0 0 0 0 0
  16858. -2.3238 -0.2853 -0.3884 H 0 0 0 0 0 0 0 0 0 0 0 0
  16859. -1.6631 1.0668 1.6054 H 0 0 0 0 0 0 0 0 0 0 0 0
  16860. 2.3464 0.5686 0.8077 H 0 0 0 0 0 0 0 0 0 0 0 0
  16861. 1.8678 -0.8062 -1.2222 H 0 0 0 0 0 0 0 0 0 0 0 0
  16862. 1 2 2 0
  16863. 2 3 1 0
  16864. 3 4 2 0
  16865. 4 5 1 0
  16866. 5 6 2 0
  16867. 6 1 1 0
  16868. 1 7 1 0
  16869. 2 8 1 0
  16870. 3 9 1 0
  16871. 5 10 1 0
  16872. 6 11 1 0
  16873. M END
  16874. $$$$
  16875. RDKit 3D
  16876. 11 11 0 0 0 0 0 0 0 0999 V2000
  16877. -0.2702 -0.6406 -0.9582 C 0 0 0 0 0 0 0 0 0 0 0 0
  16878. -1.2785 -0.1166 -0.1561 C 0 0 0 0 0 0 0 0 0 0 0 0
  16879. -0.9129 0.6267 0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0
  16880. 0.3682 0.8730 1.3058 N 0 0 0 0 0 0 0 0 0 0 0 0
  16881. 1.3253 0.3513 0.5079 C 0 0 0 0 0 0 0 0 0 0 0 0
  16882. 1.0589 -0.4042 -0.6229 C 0 0 0 0 0 0 0 0 0 0 0 0
  16883. -0.5180 -1.2284 -1.8373 H 0 0 0 0 0 0 0 0 0 0 0 0
  16884. -2.3238 -0.2829 -0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0
  16885. -1.6631 1.0567 1.6121 H 0 0 0 0 0 0 0 0 0 0 0 0
  16886. 2.3464 0.5635 0.8113 H 0 0 0 0 0 0 0 0 0 0 0 0
  16887. 1.8678 -0.7985 -1.2273 H 0 0 0 0 0 0 0 0 0 0 0 0
  16888. 1 2 2 0
  16889. 2 3 1 0
  16890. 3 4 2 0
  16891. 4 5 1 0
  16892. 5 6 2 0
  16893. 6 1 1 0
  16894. 1 7 1 0
  16895. 2 8 1 0
  16896. 3 9 1 0
  16897. 5 10 1 0
  16898. 6 11 1 0
  16899. M END
  16900. $$$$
  16901. RDKit 3D
  16902. 11 11 0 0 0 0 0 0 0 0999 V2000
  16903. -0.2702 -0.6346 -0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0
  16904. -1.2785 -0.1157 -0.1568 C 0 0 0 0 0 0 0 0 0 0 0 0
  16905. -0.9129 0.6206 0.9588 C 0 0 0 0 0 0 0 0 0 0 0 0
  16906. 0.3682 0.8648 1.3112 N 0 0 0 0 0 0 0 0 0 0 0 0
  16907. 1.3253 0.3481 0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0
  16908. 1.0589 -0.4003 -0.6254 C 0 0 0 0 0 0 0 0 0 0 0 0
  16909. -0.5180 -1.2168 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0
  16910. -2.3238 -0.2804 -0.3919 H 0 0 0 0 0 0 0 0 0 0 0 0
  16911. -1.6631 1.0466 1.6187 H 0 0 0 0 0 0 0 0 0 0 0 0
  16912. 2.3464 0.5584 0.8148 H 0 0 0 0 0 0 0 0 0 0 0 0
  16913. 1.8678 -0.7908 -1.2323 H 0 0 0 0 0 0 0 0 0 0 0 0
  16914. 1 2 2 0
  16915. 2 3 1 0
  16916. 3 4 2 0
  16917. 4 5 1 0
  16918. 5 6 2 0
  16919. 6 1 1 0
  16920. 1 7 1 0
  16921. 2 8 1 0
  16922. 3 9 1 0
  16923. 5 10 1 0
  16924. 6 11 1 0
  16925. M END
  16926. $$$$
  16927. RDKit 3D
  16928. 11 11 0 0 0 0 0 0 0 0999 V2000
  16929. -0.2702 -0.6285 -0.9662 C 0 0 0 0 0 0 0 0 0 0 0 0
  16930. -1.2785 -0.1147 -0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0
  16931. -0.9129 0.6146 0.9627 C 0 0 0 0 0 0 0 0 0 0 0 0
  16932. 0.3682 0.8565 1.3166 N 0 0 0 0 0 0 0 0 0 0 0 0
  16933. 1.3253 0.3449 0.5123 C 0 0 0 0 0 0 0 0 0 0 0 0
  16934. 1.0589 -0.3963 -0.6279 C 0 0 0 0 0 0 0 0 0 0 0 0
  16935. -0.5180 -1.2052 -1.8526 H 0 0 0 0 0 0 0 0 0 0 0 0
  16936. -2.3238 -0.2779 -0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0
  16937. -1.6631 1.0364 1.6252 H 0 0 0 0 0 0 0 0 0 0 0 0
  16938. 2.3464 0.5532 0.8183 H 0 0 0 0 0 0 0 0 0 0 0 0
  16939. 1.8678 -0.7830 -1.2372 H 0 0 0 0 0 0 0 0 0 0 0 0
  16940. 1 2 2 0
  16941. 2 3 1 0
  16942. 3 4 2 0
  16943. 4 5 1 0
  16944. 5 6 2 0
  16945. 6 1 1 0
  16946. 1 7 1 0
  16947. 2 8 1 0
  16948. 3 9 1 0
  16949. 5 10 1 0
  16950. 6 11 1 0
  16951. M END
  16952. $$$$
  16953. RDKit 3D
  16954. 11 11 0 0 0 0 0 0 0 0999 V2000
  16955. -0.2702 -0.6225 -0.9701 C 0 0 0 0 0 0 0 0 0 0 0 0
  16956. -1.2785 -0.1137 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0
  16957. -0.9129 0.6085 0.9665 C 0 0 0 0 0 0 0 0 0 0 0 0
  16958. 0.3682 0.8482 1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0
  16959. 1.3253 0.3417 0.5144 C 0 0 0 0 0 0 0 0 0 0 0 0
  16960. 1.0589 -0.3924 -0.6304 C 0 0 0 0 0 0 0 0 0 0 0 0
  16961. -0.5180 -1.1935 -1.8601 H 0 0 0 0 0 0 0 0 0 0 0 0
  16962. -2.3238 -0.2755 -0.3954 H 0 0 0 0 0 0 0 0 0 0 0 0
  16963. -1.6631 1.0261 1.6317 H 0 0 0 0 0 0 0 0 0 0 0 0
  16964. 2.3464 0.5481 0.8218 H 0 0 0 0 0 0 0 0 0 0 0 0
  16965. 1.8678 -0.7752 -1.2421 H 0 0 0 0 0 0 0 0 0 0 0 0
  16966. 1 2 2 0
  16967. 2 3 1 0
  16968. 3 4 2 0
  16969. 4 5 1 0
  16970. 5 6 2 0
  16971. 6 1 1 0
  16972. 1 7 1 0
  16973. 2 8 1 0
  16974. 3 9 1 0
  16975. 5 10 1 0
  16976. 6 11 1 0
  16977. M END
  16978. $$$$
  16979. RDKit 3D
  16980. 11 11 0 0 0 0 0 0 0 0999 V2000
  16981. -0.2702 -0.6164 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0
  16982. -1.2785 -0.1127 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0
  16983. -0.9129 0.6025 0.9703 C 0 0 0 0 0 0 0 0 0 0 0 0
  16984. 0.3682 0.8399 1.3273 N 0 0 0 0 0 0 0 0 0 0 0 0
  16985. 1.3253 0.3385 0.5166 C 0 0 0 0 0 0 0 0 0 0 0 0
  16986. 1.0589 -0.3884 -0.6329 C 0 0 0 0 0 0 0 0 0 0 0 0
  16987. -0.5180 -1.1818 -1.8676 H 0 0 0 0 0 0 0 0 0 0 0 0
  16988. -2.3238 -0.2730 -0.3971 H 0 0 0 0 0 0 0 0 0 0 0 0
  16989. -1.6631 1.0159 1.6381 H 0 0 0 0 0 0 0 0 0 0 0 0
  16990. 2.3464 0.5429 0.8252 H 0 0 0 0 0 0 0 0 0 0 0 0
  16991. 1.8678 -0.7674 -1.2469 H 0 0 0 0 0 0 0 0 0 0 0 0
  16992. 1 2 2 0
  16993. 2 3 1 0
  16994. 3 4 2 0
  16995. 4 5 1 0
  16996. 5 6 2 0
  16997. 6 1 1 0
  16998. 1 7 1 0
  16999. 2 8 1 0
  17000. 3 9 1 0
  17001. 5 10 1 0
  17002. 6 11 1 0
  17003. M END
  17004. $$$$
  17005. RDKit 3D
  17006. 11 11 0 0 0 0 0 0 0 0999 V2000
  17007. -0.2702 -0.6102 -0.9779 C 0 0 0 0 0 0 0 0 0 0 0 0
  17008. -1.2785 -0.1117 -0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0
  17009. -0.9129 0.5964 0.9741 C 0 0 0 0 0 0 0 0 0 0 0 0
  17010. 0.3682 0.8316 1.3325 N 0 0 0 0 0 0 0 0 0 0 0 0
  17011. 1.3253 0.3352 0.5187 C 0 0 0 0 0 0 0 0 0 0 0 0
  17012. 1.0589 -0.3844 -0.6353 C 0 0 0 0 0 0 0 0 0 0 0 0
  17013. -0.5180 -1.1701 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0
  17014. -2.3238 -0.2705 -0.3988 H 0 0 0 0 0 0 0 0 0 0 0 0
  17015. -1.6631 1.0056 1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0
  17016. 2.3464 0.5377 0.8286 H 0 0 0 0 0 0 0 0 0 0 0 0
  17017. 1.8678 -0.7596 -1.2517 H 0 0 0 0 0 0 0 0 0 0 0 0
  17018. 1 2 2 0
  17019. 2 3 1 0
  17020. 3 4 2 0
  17021. 4 5 1 0
  17022. 5 6 2 0
  17023. 6 1 1 0
  17024. 1 7 1 0
  17025. 2 8 1 0
  17026. 3 9 1 0
  17027. 5 10 1 0
  17028. 6 11 1 0
  17029. M END
  17030. $$$$
  17031. RDKit 3D
  17032. 11 11 0 0 0 0 0 0 0 0999 V2000
  17033. -0.2702 -0.6041 -0.9817 C 0 0 0 0 0 0 0 0 0 0 0 0
  17034. -1.2785 -0.1107 -0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0
  17035. -0.9129 0.5902 0.9778 C 0 0 0 0 0 0 0 0 0 0 0 0
  17036. 0.3682 0.8232 1.3377 N 0 0 0 0 0 0 0 0 0 0 0 0
  17037. 1.3253 0.3319 0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0
  17038. 1.0589 -0.3804 -0.6377 C 0 0 0 0 0 0 0 0 0 0 0 0
  17039. -0.5180 -1.1583 -1.8823 H 0 0 0 0 0 0 0 0 0 0 0 0
  17040. -2.3238 -0.2680 -0.4005 H 0 0 0 0 0 0 0 0 0 0 0 0
  17041. -1.6631 0.9952 1.6507 H 0 0 0 0 0 0 0 0 0 0 0 0
  17042. 2.3464 0.5325 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0
  17043. 1.8678 -0.7517 -1.2565 H 0 0 0 0 0 0 0 0 0 0 0 0
  17044. 1 2 2 0
  17045. 2 3 1 0
  17046. 3 4 2 0
  17047. 4 5 1 0
  17048. 5 6 2 0
  17049. 6 1 1 0
  17050. 1 7 1 0
  17051. 2 8 1 0
  17052. 3 9 1 0
  17053. 5 10 1 0
  17054. 6 11 1 0
  17055. M END
  17056. $$$$
  17057. RDKit 3D
  17058. 11 11 0 0 0 0 0 0 0 0999 V2000
  17059. -0.2702 -0.5979 -0.9855 C 0 0 0 0 0 0 0 0 0 0 0 0
  17060. -1.2785 -0.1097 -0.1611 C 0 0 0 0 0 0 0 0 0 0 0 0
  17061. -0.9129 0.5841 0.9815 C 0 0 0 0 0 0 0 0 0 0 0 0
  17062. 0.3682 0.8148 1.3429 N 0 0 0 0 0 0 0 0 0 0 0 0
  17063. 1.3253 0.3287 0.5228 C 0 0 0 0 0 0 0 0 0 0 0 0
  17064. 1.0589 -0.3764 -0.6401 C 0 0 0 0 0 0 0 0 0 0 0 0
  17065. -0.5180 -1.1464 -1.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
  17066. -2.3238 -0.2654 -0.4022 H 0 0 0 0 0 0 0 0 0 0 0 0
  17067. -1.6631 0.9848 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0
  17068. 2.3464 0.5273 0.8353 H 0 0 0 0 0 0 0 0 0 0 0 0
  17069. 1.8678 -0.7438 -1.2612 H 0 0 0 0 0 0 0 0 0 0 0 0
  17070. 1 2 2 0
  17071. 2 3 1 0
  17072. 3 4 2 0
  17073. 4 5 1 0
  17074. 5 6 2 0
  17075. 6 1 1 0
  17076. 1 7 1 0
  17077. 2 8 1 0
  17078. 3 9 1 0
  17079. 5 10 1 0
  17080. 6 11 1 0
  17081. M END
  17082. $$$$
  17083. RDKit 3D
  17084. 11 11 0 0 0 0 0 0 0 0999 V2000
  17085. -0.2702 -0.5917 -0.9892 C 0 0 0 0 0 0 0 0 0 0 0 0
  17086. -1.2785 -0.1086 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0
  17087. -0.9129 0.5779 0.9852 C 0 0 0 0 0 0 0 0 0 0 0 0
  17088. 0.3682 0.8063 1.3480 N 0 0 0 0 0 0 0 0 0 0 0 0
  17089. 1.3253 0.3254 0.5249 C 0 0 0 0 0 0 0 0 0 0 0 0
  17090. 1.0589 -0.3724 -0.6424 C 0 0 0 0 0 0 0 0 0 0 0 0
  17091. -0.5180 -1.1345 -1.8967 H 0 0 0 0 0 0 0 0 0 0 0 0
  17092. -2.3238 -0.2629 -0.4039 H 0 0 0 0 0 0 0 0 0 0 0 0
  17093. -1.6631 0.9744 1.6631 H 0 0 0 0 0 0 0 0 0 0 0 0
  17094. 2.3464 0.5220 0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0
  17095. 1.8678 -0.7358 -1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0
  17096. 1 2 2 0
  17097. 2 3 1 0
  17098. 3 4 2 0
  17099. 4 5 1 0
  17100. 5 6 2 0
  17101. 6 1 1 0
  17102. 1 7 1 0
  17103. 2 8 1 0
  17104. 3 9 1 0
  17105. 5 10 1 0
  17106. 6 11 1 0
  17107. M END
  17108. $$$$
  17109. RDKit 3D
  17110. 11 11 0 0 0 0 0 0 0 0999 V2000
  17111. -0.2702 -0.5855 -0.9929 C 0 0 0 0 0 0 0 0 0 0 0 0
  17112. -1.2785 -0.1076 -0.1624 C 0 0 0 0 0 0 0 0 0 0 0 0
  17113. -0.9129 0.5717 0.9888 C 0 0 0 0 0 0 0 0 0 0 0 0
  17114. 0.3682 0.7978 1.3530 N 0 0 0 0 0 0 0 0 0 0 0 0
  17115. 1.3253 0.3221 0.5269 C 0 0 0 0 0 0 0 0 0 0 0 0
  17116. 1.0589 -0.3683 -0.6448 C 0 0 0 0 0 0 0 0 0 0 0 0
  17117. -0.5180 -1.1226 -1.9038 H 0 0 0 0 0 0 0 0 0 0 0 0
  17118. -2.3238 -0.2604 -0.4055 H 0 0 0 0 0 0 0 0 0 0 0 0
  17119. -1.6631 0.9639 1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0
  17120. 2.3464 0.5167 0.8418 H 0 0 0 0 0 0 0 0 0 0 0 0
  17121. 1.8678 -0.7279 -1.2704 H 0 0 0 0 0 0 0 0 0 0 0 0
  17122. 1 2 2 0
  17123. 2 3 1 0
  17124. 3 4 2 0
  17125. 4 5 1 0
  17126. 5 6 2 0
  17127. 6 1 1 0
  17128. 1 7 1 0
  17129. 2 8 1 0
  17130. 3 9 1 0
  17131. 5 10 1 0
  17132. 6 11 1 0
  17133. M END
  17134. $$$$
  17135. RDKit 3D
  17136. 11 11 0 0 0 0 0 0 0 0999 V2000
  17137. -0.2702 -0.5792 -0.9965 C 0 0 0 0 0 0 0 0 0 0 0 0
  17138. -1.2785 -0.1066 -0.1631 C 0 0 0 0 0 0 0 0 0 0 0 0
  17139. -0.9129 0.5655 0.9924 C 0 0 0 0 0 0 0 0 0 0 0 0
  17140. 0.3682 0.7893 1.3580 N 0 0 0 0 0 0 0 0 0 0 0 0
  17141. 1.3253 0.3187 0.5289 C 0 0 0 0 0 0 0 0 0 0 0 0
  17142. 1.0589 -0.3643 -0.6471 C 0 0 0 0 0 0 0 0 0 0 0 0
  17143. -0.5180 -1.1106 -1.9108 H 0 0 0 0 0 0 0 0 0 0 0 0
  17144. -2.3238 -0.2578 -0.4071 H 0 0 0 0 0 0 0 0 0 0 0 0
  17145. -1.6631 0.9534 1.6752 H 0 0 0 0 0 0 0 0 0 0 0 0
  17146. 2.3464 0.5114 0.8451 H 0 0 0 0 0 0 0 0 0 0 0 0
  17147. 1.8678 -0.7199 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  17148. 1 2 2 0
  17149. 2 3 1 0
  17150. 3 4 2 0
  17151. 4 5 1 0
  17152. 5 6 2 0
  17153. 6 1 1 0
  17154. 1 7 1 0
  17155. 2 8 1 0
  17156. 3 9 1 0
  17157. 5 10 1 0
  17158. 6 11 1 0
  17159. M END
  17160. $$$$
  17161. RDKit 3D
  17162. 11 11 0 0 0 0 0 0 0 0999 V2000
  17163. -0.2702 -0.5729 -1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
  17164. -1.2785 -0.1056 -0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0
  17165. -0.9129 0.5592 0.9959 C 0 0 0 0 0 0 0 0 0 0 0 0
  17166. 0.3682 0.7807 1.3629 N 0 0 0 0 0 0 0 0 0 0 0 0
  17167. 1.3253 0.3154 0.5309 C 0 0 0 0 0 0 0 0 0 0 0 0
  17168. 1.0589 -0.3602 -0.6493 C 0 0 0 0 0 0 0 0 0 0 0 0
  17169. -0.5180 -1.0986 -1.9177 H 0 0 0 0 0 0 0 0 0 0 0 0
  17170. -2.3238 -0.2552 -0.4088 H 0 0 0 0 0 0 0 0 0 0 0 0
  17171. -1.6631 0.9429 1.6812 H 0 0 0 0 0 0 0 0 0 0 0 0
  17172. 2.3464 0.5061 0.8483 H 0 0 0 0 0 0 0 0 0 0 0 0
  17173. 1.8678 -0.7118 -1.2795 H 0 0 0 0 0 0 0 0 0 0 0 0
  17174. 1 2 2 0
  17175. 2 3 1 0
  17176. 3 4 2 0
  17177. 4 5 1 0
  17178. 5 6 2 0
  17179. 6 1 1 0
  17180. 1 7 1 0
  17181. 2 8 1 0
  17182. 3 9 1 0
  17183. 5 10 1 0
  17184. 6 11 1 0
  17185. M END
  17186. $$$$
  17187. RDKit 3D
  17188. 11 11 0 0 0 0 0 0 0 0999 V2000
  17189. -0.2702 -0.5666 -1.0037 C 0 0 0 0 0 0 0 0 0 0 0 0
  17190. -1.2785 -0.1045 -0.1644 C 0 0 0 0 0 0 0 0 0 0 0 0
  17191. -0.9129 0.5529 0.9994 C 0 0 0 0 0 0 0 0 0 0 0 0
  17192. 0.3682 0.7722 1.3678 N 0 0 0 0 0 0 0 0 0 0 0 0
  17193. 1.3253 0.3121 0.5329 C 0 0 0 0 0 0 0 0 0 0 0 0
  17194. 1.0589 -0.3561 -0.6516 C 0 0 0 0 0 0 0 0 0 0 0 0
  17195. -0.5180 -1.0865 -1.9246 H 0 0 0 0 0 0 0 0 0 0 0 0
  17196. -2.3238 -0.2527 -0.4103 H 0 0 0 0 0 0 0 0 0 0 0 0
  17197. -1.6631 0.9323 1.6871 H 0 0 0 0 0 0 0 0 0 0 0 0
  17198. 2.3464 0.5008 0.8514 H 0 0 0 0 0 0 0 0 0 0 0 0
  17199. 1.8678 -0.7038 -1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0
  17200. 1 2 2 0
  17201. 2 3 1 0
  17202. 3 4 2 0
  17203. 4 5 1 0
  17204. 5 6 2 0
  17205. 6 1 1 0
  17206. 1 7 1 0
  17207. 2 8 1 0
  17208. 3 9 1 0
  17209. 5 10 1 0
  17210. 6 11 1 0
  17211. M END
  17212. $$$$
  17213. RDKit 3D
  17214. 11 11 0 0 0 0 0 0 0 0999 V2000
  17215. -0.2702 -0.5603 -1.0073 C 0 0 0 0 0 0 0 0 0 0 0 0
  17216. -1.2785 -0.1035 -0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0
  17217. -0.9129 0.5467 1.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
  17218. 0.3682 0.7636 1.3726 N 0 0 0 0 0 0 0 0 0 0 0 0
  17219. 1.3253 0.3087 0.5349 C 0 0 0 0 0 0 0 0 0 0 0 0
  17220. 1.0589 -0.3520 -0.6538 C 0 0 0 0 0 0 0 0 0 0 0 0
  17221. -0.5180 -1.0744 -1.9314 H 0 0 0 0 0 0 0 0 0 0 0 0
  17222. -2.3238 -0.2501 -0.4119 H 0 0 0 0 0 0 0 0 0 0 0 0
  17223. -1.6631 0.9217 1.6929 H 0 0 0 0 0 0 0 0 0 0 0 0
  17224. 2.3464 0.4954 0.8546 H 0 0 0 0 0 0 0 0 0 0 0 0
  17225. 1.8678 -0.6957 -1.2883 H 0 0 0 0 0 0 0 0 0 0 0 0
  17226. 1 2 2 0
  17227. 2 3 1 0
  17228. 3 4 2 0
  17229. 4 5 1 0
  17230. 5 6 2 0
  17231. 6 1 1 0
  17232. 1 7 1 0
  17233. 2 8 1 0
  17234. 3 9 1 0
  17235. 5 10 1 0
  17236. 6 11 1 0
  17237. M END
  17238. $$$$
  17239. RDKit 3D
  17240. 11 11 0 0 0 0 0 0 0 0999 V2000
  17241. -0.2702 -0.5540 -1.0108 C 0 0 0 0 0 0 0 0 0 0 0 0
  17242. -1.2785 -0.1025 -0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0
  17243. -0.9129 0.5403 1.0063 C 0 0 0 0 0 0 0 0 0 0 0 0
  17244. 0.3682 0.7549 1.3774 N 0 0 0 0 0 0 0 0 0 0 0 0
  17245. 1.3253 0.3053 0.5368 C 0 0 0 0 0 0 0 0 0 0 0 0
  17246. 1.0589 -0.3479 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0
  17247. -0.5180 -1.0622 -1.9381 H 0 0 0 0 0 0 0 0 0 0 0 0
  17248. -2.3238 -0.2475 -0.4135 H 0 0 0 0 0 0 0 0 0 0 0 0
  17249. -1.6631 0.9110 1.6987 H 0 0 0 0 0 0 0 0 0 0 0 0
  17250. 2.3464 0.4900 0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0
  17251. 1.8678 -0.6876 -1.2927 H 0 0 0 0 0 0 0 0 0 0 0 0
  17252. 1 2 2 0
  17253. 2 3 1 0
  17254. 3 4 2 0
  17255. 4 5 1 0
  17256. 5 6 2 0
  17257. 6 1 1 0
  17258. 1 7 1 0
  17259. 2 8 1 0
  17260. 3 9 1 0
  17261. 5 10 1 0
  17262. 6 11 1 0
  17263. M END
  17264. $$$$
  17265. RDKit 3D
  17266. 11 11 0 0 0 0 0 0 0 0999 V2000
  17267. -0.2702 -0.5476 -1.0142 C 0 0 0 0 0 0 0 0 0 0 0 0
  17268. -1.2785 -0.1014 -0.1664 C 0 0 0 0 0 0 0 0 0 0 0 0
  17269. -0.9129 0.5340 1.0096 C 0 0 0 0 0 0 0 0 0 0 0 0
  17270. 0.3682 0.7462 1.3821 N 0 0 0 0 0 0 0 0 0 0 0 0
  17271. 1.3253 0.3020 0.5387 C 0 0 0 0 0 0 0 0 0 0 0 0
  17272. 1.0589 -0.3438 -0.6582 C 0 0 0 0 0 0 0 0 0 0 0 0
  17273. -0.5180 -1.0500 -1.9447 H 0 0 0 0 0 0 0 0 0 0 0 0
  17274. -2.3238 -0.2449 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0
  17275. -1.6631 0.9003 1.7044 H 0 0 0 0 0 0 0 0 0 0 0 0
  17276. 2.3464 0.4846 0.8607 H 0 0 0 0 0 0 0 0 0 0 0 0
  17277. 1.8678 -0.6795 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  17278. 1 2 2 0
  17279. 2 3 1 0
  17280. 3 4 2 0
  17281. 4 5 1 0
  17282. 5 6 2 0
  17283. 6 1 1 0
  17284. 1 7 1 0
  17285. 2 8 1 0
  17286. 3 9 1 0
  17287. 5 10 1 0
  17288. 6 11 1 0
  17289. M END
  17290. $$$$
  17291. RDKit 3D
  17292. 11 11 0 0 0 0 0 0 0 0999 V2000
  17293. -0.2702 -0.5412 -1.0177 C 0 0 0 0 0 0 0 0 0 0 0 0
  17294. -1.2785 -0.1004 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0
  17295. -0.9129 0.5277 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0
  17296. 0.3682 0.7376 1.3868 N 0 0 0 0 0 0 0 0 0 0 0 0
  17297. 1.3253 0.2986 0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0
  17298. 1.0589 -0.3396 -0.6603 C 0 0 0 0 0 0 0 0 0 0 0 0
  17299. -0.5180 -1.0378 -1.9513 H 0 0 0 0 0 0 0 0 0 0 0 0
  17300. -2.3238 -0.2423 -0.4166 H 0 0 0 0 0 0 0 0 0 0 0 0
  17301. -1.6631 0.8896 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0
  17302. 2.3464 0.4792 0.8638 H 0 0 0 0 0 0 0 0 0 0 0 0
  17303. 1.8678 -0.6713 -1.3012 H 0 0 0 0 0 0 0 0 0 0 0 0
  17304. 1 2 2 0
  17305. 2 3 1 0
  17306. 3 4 2 0
  17307. 4 5 1 0
  17308. 5 6 2 0
  17309. 6 1 1 0
  17310. 1 7 1 0
  17311. 2 8 1 0
  17312. 3 9 1 0
  17313. 5 10 1 0
  17314. 6 11 1 0
  17315. M END
  17316. $$$$
  17317. RDKit 3D
  17318. 11 11 0 0 0 0 0 0 0 0999 V2000
  17319. -0.2702 -0.5348 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
  17320. -1.2785 -0.0993 -0.1676 C 0 0 0 0 0 0 0 0 0 0 0 0
  17321. -0.9129 0.5213 1.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
  17322. 0.3682 0.7288 1.3914 N 0 0 0 0 0 0 0 0 0 0 0 0
  17323. 1.3253 0.2952 0.5424 C 0 0 0 0 0 0 0 0 0 0 0 0
  17324. 1.0589 -0.3355 -0.6624 C 0 0 0 0 0 0 0 0 0 0 0 0
  17325. -0.5180 -1.0255 -1.9578 H 0 0 0 0 0 0 0 0 0 0 0 0
  17326. -2.3238 -0.2397 -0.4181 H 0 0 0 0 0 0 0 0 0 0 0 0
  17327. -1.6631 0.8788 1.7155 H 0 0 0 0 0 0 0 0 0 0 0 0
  17328. 2.3464 0.4738 0.8667 H 0 0 0 0 0 0 0 0 0 0 0 0
  17329. 1.8678 -0.6631 -1.3054 H 0 0 0 0 0 0 0 0 0 0 0 0
  17330. 1 2 2 0
  17331. 2 3 1 0
  17332. 3 4 2 0
  17333. 4 5 1 0
  17334. 5 6 2 0
  17335. 6 1 1 0
  17336. 1 7 1 0
  17337. 2 8 1 0
  17338. 3 9 1 0
  17339. 5 10 1 0
  17340. 6 11 1 0
  17341. M END
  17342. $$$$
  17343. RDKit 3D
  17344. 11 11 0 0 0 0 0 0 0 0999 V2000
  17345. -0.2702 -0.5284 -1.0244 C 0 0 0 0 0 0 0 0 0 0 0 0
  17346. -1.2785 -0.0983 -0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
  17347. -0.9129 0.5149 1.0195 C 0 0 0 0 0 0 0 0 0 0 0 0
  17348. 0.3682 0.7201 1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0
  17349. 1.3253 0.2918 0.5443 C 0 0 0 0 0 0 0 0 0 0 0 0
  17350. 1.0589 -0.3313 -0.6645 C 0 0 0 0 0 0 0 0 0 0 0 0
  17351. -0.5180 -1.0132 -1.9642 H 0 0 0 0 0 0 0 0 0 0 0 0
  17352. -2.3238 -0.2370 -0.4196 H 0 0 0 0 0 0 0 0 0 0 0 0
  17353. -1.6631 0.8680 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0
  17354. 2.3464 0.4683 0.8697 H 0 0 0 0 0 0 0 0 0 0 0 0
  17355. 1.8678 -0.6549 -1.3095 H 0 0 0 0 0 0 0 0 0 0 0 0
  17356. 1 2 2 0
  17357. 2 3 1 0
  17358. 3 4 2 0
  17359. 4 5 1 0
  17360. 5 6 2 0
  17361. 6 1 1 0
  17362. 1 7 1 0
  17363. 2 8 1 0
  17364. 3 9 1 0
  17365. 5 10 1 0
  17366. 6 11 1 0
  17367. M END
  17368. $$$$
  17369. RDKit 3D
  17370. 11 11 0 0 0 0 0 0 0 0999 V2000
  17371. -0.2702 -0.5220 -1.0277 C 0 0 0 0 0 0 0 0 0 0 0 0
  17372. -1.2785 -0.0972 -0.1689 C 0 0 0 0 0 0 0 0 0 0 0 0
  17373. -0.9129 0.5085 1.0227 C 0 0 0 0 0 0 0 0 0 0 0 0
  17374. 0.3682 0.7113 1.4005 N 0 0 0 0 0 0 0 0 0 0 0 0
  17375. 1.3253 0.2883 0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0
  17376. 1.0589 -0.3271 -0.6666 C 0 0 0 0 0 0 0 0 0 0 0 0
  17377. -0.5180 -1.0008 -1.9705 H 0 0 0 0 0 0 0 0 0 0 0 0
  17378. -2.3238 -0.2344 -0.4211 H 0 0 0 0 0 0 0 0 0 0 0 0
  17379. -1.6631 0.8572 1.7264 H 0 0 0 0 0 0 0 0 0 0 0 0
  17380. 2.3464 0.4629 0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0
  17381. 1.8678 -0.6467 -1.3136 H 0 0 0 0 0 0 0 0 0 0 0 0
  17382. 1 2 2 0
  17383. 2 3 1 0
  17384. 3 4 2 0
  17385. 4 5 1 0
  17386. 5 6 2 0
  17387. 6 1 1 0
  17388. 1 7 1 0
  17389. 2 8 1 0
  17390. 3 9 1 0
  17391. 5 10 1 0
  17392. 6 11 1 0
  17393. M END
  17394. $$$$
  17395. RDKit 3D
  17396. 11 11 0 0 0 0 0 0 0 0999 V2000
  17397. -0.2702 -0.5155 -1.0309 C 0 0 0 0 0 0 0 0 0 0 0 0
  17398. -1.2785 -0.0962 -0.1695 C 0 0 0 0 0 0 0 0 0 0 0 0
  17399. -0.9129 0.5020 1.0259 C 0 0 0 0 0 0 0 0 0 0 0 0
  17400. 0.3682 0.7025 1.4049 N 0 0 0 0 0 0 0 0 0 0 0 0
  17401. 1.3253 0.2849 0.5479 C 0 0 0 0 0 0 0 0 0 0 0 0
  17402. 1.0589 -0.3229 -0.6687 C 0 0 0 0 0 0 0 0 0 0 0 0
  17403. -0.5180 -0.9884 -1.9768 H 0 0 0 0 0 0 0 0 0 0 0 0
  17404. -2.3238 -0.2317 -0.4225 H 0 0 0 0 0 0 0 0 0 0 0 0
  17405. -1.6631 0.8463 1.7318 H 0 0 0 0 0 0 0 0 0 0 0 0
  17406. 2.3464 0.4574 0.8755 H 0 0 0 0 0 0 0 0 0 0 0 0
  17407. 1.8678 -0.6384 -1.3177 H 0 0 0 0 0 0 0 0 0 0 0 0
  17408. 1 2 2 0
  17409. 2 3 1 0
  17410. 3 4 2 0
  17411. 4 5 1 0
  17412. 5 6 2 0
  17413. 6 1 1 0
  17414. 1 7 1 0
  17415. 2 8 1 0
  17416. 3 9 1 0
  17417. 5 10 1 0
  17418. 6 11 1 0
  17419. M END
  17420. $$$$
  17421. RDKit 3D
  17422. 11 11 0 0 0 0 0 0 0 0999 V2000
  17423. -0.2702 -0.5090 -1.0342 C 0 0 0 0 0 0 0 0 0 0 0 0
  17424. -1.2785 -0.0951 -0.1701 C 0 0 0 0 0 0 0 0 0 0 0 0
  17425. -0.9129 0.4956 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  17426. 0.3682 0.6936 1.4093 N 0 0 0 0 0 0 0 0 0 0 0 0
  17427. 1.3253 0.2815 0.5497 C 0 0 0 0 0 0 0 0 0 0 0 0
  17428. 1.0589 -0.3187 -0.6707 C 0 0 0 0 0 0 0 0 0 0 0 0
  17429. -0.5180 -0.9760 -1.9829 H 0 0 0 0 0 0 0 0 0 0 0 0
  17430. -2.3238 -0.2291 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  17431. -1.6631 0.8354 1.7371 H 0 0 0 0 0 0 0 0 0 0 0 0
  17432. 2.3464 0.4519 0.8784 H 0 0 0 0 0 0 0 0 0 0 0 0
  17433. 1.8678 -0.6301 -1.3217 H 0 0 0 0 0 0 0 0 0 0 0 0
  17434. 1 2 2 0
  17435. 2 3 1 0
  17436. 3 4 2 0
  17437. 4 5 1 0
  17438. 5 6 2 0
  17439. 6 1 1 0
  17440. 1 7 1 0
  17441. 2 8 1 0
  17442. 3 9 1 0
  17443. 5 10 1 0
  17444. 6 11 1 0
  17445. M END
  17446. $$$$
  17447. RDKit 3D
  17448. 11 11 0 0 0 0 0 0 0 0999 V2000
  17449. -0.2702 -0.5025 -1.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
  17450. -1.2785 -0.0940 -0.1707 C 0 0 0 0 0 0 0 0 0 0 0 0
  17451. -0.9129 0.4891 1.0321 C 0 0 0 0 0 0 0 0 0 0 0 0
  17452. 0.3682 0.6848 1.4136 N 0 0 0 0 0 0 0 0 0 0 0 0
  17453. 1.3253 0.2780 0.5515 C 0 0 0 0 0 0 0 0 0 0 0 0
  17454. 1.0589 -0.3145 -0.6727 C 0 0 0 0 0 0 0 0 0 0 0 0
  17455. -0.5180 -0.9635 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0
  17456. -2.3238 -0.2264 -0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0
  17457. -1.6631 0.8245 1.7423 H 0 0 0 0 0 0 0 0 0 0 0 0
  17458. 2.3464 0.4463 0.8812 H 0 0 0 0 0 0 0 0 0 0 0 0
  17459. 1.8678 -0.6218 -1.3256 H 0 0 0 0 0 0 0 0 0 0 0 0
  17460. 1 2 2 0
  17461. 2 3 1 0
  17462. 3 4 2 0
  17463. 4 5 1 0
  17464. 5 6 2 0
  17465. 6 1 1 0
  17466. 1 7 1 0
  17467. 2 8 1 0
  17468. 3 9 1 0
  17469. 5 10 1 0
  17470. 6 11 1 0
  17471. M END
  17472. $$$$
  17473. RDKit 3D
  17474. 11 11 0 0 0 0 0 0 0 0999 V2000
  17475. -0.2702 -0.4960 -1.0405 C 0 0 0 0 0 0 0 0 0 0 0 0
  17476. -1.2785 -0.0929 -0.1713 C 0 0 0 0 0 0 0 0 0 0 0 0
  17477. -0.9129 0.4826 1.0352 C 0 0 0 0 0 0 0 0 0 0 0 0
  17478. 0.3682 0.6759 1.4179 N 0 0 0 0 0 0 0 0 0 0 0 0
  17479. 1.3253 0.2745 0.5532 C 0 0 0 0 0 0 0 0 0 0 0 0
  17480. 1.0589 -0.3103 -0.6746 C 0 0 0 0 0 0 0 0 0 0 0 0
  17481. -0.5180 -0.9510 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
  17482. -2.3238 -0.2237 -0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0
  17483. -1.6631 0.8135 1.7474 H 0 0 0 0 0 0 0 0 0 0 0 0
  17484. 2.3464 0.4408 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  17485. 1.8678 -0.6134 -1.3295 H 0 0 0 0 0 0 0 0 0 0 0 0
  17486. 1 2 2 0
  17487. 2 3 1 0
  17488. 3 4 2 0
  17489. 4 5 1 0
  17490. 5 6 2 0
  17491. 6 1 1 0
  17492. 1 7 1 0
  17493. 2 8 1 0
  17494. 3 9 1 0
  17495. 5 10 1 0
  17496. 6 11 1 0
  17497. M END
  17498. $$$$
  17499. RDKit 3D
  17500. 11 11 0 0 0 0 0 0 0 0999 V2000
  17501. -0.2702 -0.4894 -1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0
  17502. -1.2785 -0.0919 -0.1718 C 0 0 0 0 0 0 0 0 0 0 0 0
  17503. -0.9129 0.4761 1.0382 C 0 0 0 0 0 0 0 0 0 0 0 0
  17504. 0.3682 0.6669 1.4221 N 0 0 0 0 0 0 0 0 0 0 0 0
  17505. 1.3253 0.2710 0.5549 C 0 0 0 0 0 0 0 0 0 0 0 0
  17506. 1.0589 -0.3060 -0.6766 C 0 0 0 0 0 0 0 0 0 0 0 0
  17507. -0.5180 -0.9384 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  17508. -2.3238 -0.2210 -0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0
  17509. -1.6631 0.8026 1.7525 H 0 0 0 0 0 0 0 0 0 0 0 0
  17510. 2.3464 0.4352 0.8867 H 0 0 0 0 0 0 0 0 0 0 0 0
  17511. 1.8678 -0.6051 -1.3333 H 0 0 0 0 0 0 0 0 0 0 0 0
  17512. 1 2 2 0
  17513. 2 3 1 0
  17514. 3 4 2 0
  17515. 4 5 1 0
  17516. 5 6 2 0
  17517. 6 1 1 0
  17518. 1 7 1 0
  17519. 2 8 1 0
  17520. 3 9 1 0
  17521. 5 10 1 0
  17522. 6 11 1 0
  17523. M END
  17524. $$$$
  17525. RDKit 3D
  17526. 11 11 0 0 0 0 0 0 0 0999 V2000
  17527. -0.2702 -0.4829 -1.0466 C 0 0 0 0 0 0 0 0 0 0 0 0
  17528. -1.2785 -0.0908 -0.1724 C 0 0 0 0 0 0 0 0 0 0 0 0
  17529. -0.9129 0.4696 1.0412 C 0 0 0 0 0 0 0 0 0 0 0 0
  17530. 0.3682 0.6580 1.4263 N 0 0 0 0 0 0 0 0 0 0 0 0
  17531. 1.3253 0.2675 0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0
  17532. 1.0589 -0.3018 -0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0
  17533. -0.5180 -0.9258 -2.0068 H 0 0 0 0 0 0 0 0 0 0 0 0
  17534. -2.3238 -0.2184 -0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0
  17535. -1.6631 0.7915 1.7575 H 0 0 0 0 0 0 0 0 0 0 0 0
  17536. 2.3464 0.4296 0.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
  17537. 1.8678 -0.5967 -1.3371 H 0 0 0 0 0 0 0 0 0 0 0 0
  17538. 1 2 2 0
  17539. 2 3 1 0
  17540. 3 4 2 0
  17541. 4 5 1 0
  17542. 5 6 2 0
  17543. 6 1 1 0
  17544. 1 7 1 0
  17545. 2 8 1 0
  17546. 3 9 1 0
  17547. 5 10 1 0
  17548. 6 11 1 0
  17549. M END
  17550. $$$$
  17551. RDKit 3D
  17552. 11 11 0 0 0 0 0 0 0 0999 V2000
  17553. -0.2702 -0.4763 -1.0496 C 0 0 0 0 0 0 0 0 0 0 0 0
  17554. -1.2785 -0.0897 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0
  17555. -0.9129 0.4630 1.0441 C 0 0 0 0 0 0 0 0 0 0 0 0
  17556. 0.3682 0.6490 1.4304 N 0 0 0 0 0 0 0 0 0 0 0 0
  17557. 1.3253 0.2640 0.5583 C 0 0 0 0 0 0 0 0 0 0 0 0
  17558. 1.0589 -0.2975 -0.6803 C 0 0 0 0 0 0 0 0 0 0 0 0
  17559. -0.5180 -0.9132 -2.0126 H 0 0 0 0 0 0 0 0 0 0 0 0
  17560. -2.3238 -0.2156 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0
  17561. -1.6631 0.7805 1.7625 H 0 0 0 0 0 0 0 0 0 0 0 0
  17562. 2.3464 0.4240 0.8921 H 0 0 0 0 0 0 0 0 0 0 0 0
  17563. 1.8678 -0.5883 -1.3408 H 0 0 0 0 0 0 0 0 0 0 0 0
  17564. 1 2 2 0
  17565. 2 3 1 0
  17566. 3 4 2 0
  17567. 4 5 1 0
  17568. 5 6 2 0
  17569. 6 1 1 0
  17570. 1 7 1 0
  17571. 2 8 1 0
  17572. 3 9 1 0
  17573. 5 10 1 0
  17574. 6 11 1 0
  17575. M END
  17576. $$$$
  17577. RDKit 3D
  17578. 11 11 0 0 0 0 0 0 0 0999 V2000
  17579. -0.2702 -0.4697 -1.0526 C 0 0 0 0 0 0 0 0 0 0 0 0
  17580. -1.2785 -0.0886 -0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0
  17581. -0.9129 0.4564 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0
  17582. 0.3682 0.6400 1.4344 N 0 0 0 0 0 0 0 0 0 0 0 0
  17583. 1.3253 0.2605 0.5599 C 0 0 0 0 0 0 0 0 0 0 0 0
  17584. 1.0589 -0.2932 -0.6822 C 0 0 0 0 0 0 0 0 0 0 0 0
  17585. -0.5180 -0.9005 -2.0183 H 0 0 0 0 0 0 0 0 0 0 0 0
  17586. -2.3238 -0.2129 -0.4323 H 0 0 0 0 0 0 0 0 0 0 0 0
  17587. -1.6631 0.7694 1.7673 H 0 0 0 0 0 0 0 0 0 0 0 0
  17588. 2.3464 0.4184 0.8948 H 0 0 0 0 0 0 0 0 0 0 0 0
  17589. 1.8678 -0.5798 -1.3445 H 0 0 0 0 0 0 0 0 0 0 0 0
  17590. 1 2 2 0
  17591. 2 3 1 0
  17592. 3 4 2 0
  17593. 4 5 1 0
  17594. 5 6 2 0
  17595. 6 1 1 0
  17596. 1 7 1 0
  17597. 2 8 1 0
  17598. 3 9 1 0
  17599. 5 10 1 0
  17600. 6 11 1 0
  17601. M END
  17602. $$$$
  17603. RDKit 3D
  17604. 11 11 0 0 0 0 0 0 0 0999 V2000
  17605. -0.2702 -0.4630 -1.0555 C 0 0 0 0 0 0 0 0 0 0 0 0
  17606. -1.2785 -0.0875 -0.1741 C 0 0 0 0 0 0 0 0 0 0 0 0
  17607. -0.9129 0.4499 1.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
  17608. 0.3682 0.6310 1.4384 N 0 0 0 0 0 0 0 0 0 0 0 0
  17609. 1.3253 0.2570 0.5615 C 0 0 0 0 0 0 0 0 0 0 0 0
  17610. 1.0589 -0.2889 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0
  17611. -0.5180 -0.8878 -2.0239 H 0 0 0 0 0 0 0 0 0 0 0 0
  17612. -2.3238 -0.2102 -0.4336 H 0 0 0 0 0 0 0 0 0 0 0 0
  17613. -1.6631 0.7583 1.7721 H 0 0 0 0 0 0 0 0 0 0 0 0
  17614. 2.3464 0.4128 0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0
  17615. 1.8678 -0.5714 -1.3481 H 0 0 0 0 0 0 0 0 0 0 0 0
  17616. 1 2 2 0
  17617. 2 3 1 0
  17618. 3 4 2 0
  17619. 4 5 1 0
  17620. 5 6 2 0
  17621. 6 1 1 0
  17622. 1 7 1 0
  17623. 2 8 1 0
  17624. 3 9 1 0
  17625. 5 10 1 0
  17626. 6 11 1 0
  17627. M END
  17628. $$$$
  17629. RDKit 3D
  17630. 11 11 0 0 0 0 0 0 0 0999 V2000
  17631. -0.2702 -0.4564 -1.0584 C 0 0 0 0 0 0 0 0 0 0 0 0
  17632. -1.2785 -0.0864 -0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
  17633. -0.9129 0.4433 1.0526 C 0 0 0 0 0 0 0 0 0 0 0 0
  17634. 0.3682 0.6219 1.4423 N 0 0 0 0 0 0 0 0 0 0 0 0
  17635. 1.3253 0.2535 0.5631 C 0 0 0 0 0 0 0 0 0 0 0 0
  17636. 1.0589 -0.2846 -0.6858 C 0 0 0 0 0 0 0 0 0 0 0 0
  17637. -0.5180 -0.8751 -2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0
  17638. -2.3238 -0.2075 -0.4349 H 0 0 0 0 0 0 0 0 0 0 0 0
  17639. -1.6631 0.7471 1.7769 H 0 0 0 0 0 0 0 0 0 0 0 0
  17640. 2.3464 0.4071 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0
  17641. 1.8678 -0.5629 -1.3516 H 0 0 0 0 0 0 0 0 0 0 0 0
  17642. 1 2 2 0
  17643. 2 3 1 0
  17644. 3 4 2 0
  17645. 4 5 1 0
  17646. 5 6 2 0
  17647. 6 1 1 0
  17648. 1 7 1 0
  17649. 2 8 1 0
  17650. 3 9 1 0
  17651. 5 10 1 0
  17652. 6 11 1 0
  17653. M END
  17654. $$$$
  17655. RDKit 3D
  17656. 11 11 0 0 0 0 0 0 0 0999 V2000
  17657. -0.2702 -0.4497 -1.0613 C 0 0 0 0 0 0 0 0 0 0 0 0
  17658. -1.2785 -0.0853 -0.1752 C 0 0 0 0 0 0 0 0 0 0 0 0
  17659. -0.9129 0.4366 1.0554 C 0 0 0 0 0 0 0 0 0 0 0 0
  17660. 0.3682 0.6129 1.4462 N 0 0 0 0 0 0 0 0 0 0 0 0
  17661. 1.3253 0.2499 0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0
  17662. 1.0589 -0.2803 -0.6876 C 0 0 0 0 0 0 0 0 0 0 0 0
  17663. -0.5180 -0.8623 -2.0349 H 0 0 0 0 0 0 0 0 0 0 0 0
  17664. -2.3238 -0.2048 -0.4362 H 0 0 0 0 0 0 0 0 0 0 0 0
  17665. -1.6631 0.7359 1.7815 H 0 0 0 0 0 0 0 0 0 0 0 0
  17666. 2.3464 0.4015 0.9025 H 0 0 0 0 0 0 0 0 0 0 0 0
  17667. 1.8678 -0.5544 -1.3552 H 0 0 0 0 0 0 0 0 0 0 0 0
  17668. 1 2 2 0
  17669. 2 3 1 0
  17670. 3 4 2 0
  17671. 4 5 1 0
  17672. 5 6 2 0
  17673. 6 1 1 0
  17674. 1 7 1 0
  17675. 2 8 1 0
  17676. 3 9 1 0
  17677. 5 10 1 0
  17678. 6 11 1 0
  17679. M END
  17680. $$$$
  17681. RDKit 3D
  17682. 11 11 0 0 0 0 0 0 0 0999 V2000
  17683. -0.2702 -0.4431 -1.0641 C 0 0 0 0 0 0 0 0 0 0 0 0
  17684. -1.2785 -0.0842 -0.1757 C 0 0 0 0 0 0 0 0 0 0 0 0
  17685. -0.9129 0.4300 1.0581 C 0 0 0 0 0 0 0 0 0 0 0 0
  17686. 0.3682 0.6038 1.4501 N 0 0 0 0 0 0 0 0 0 0 0 0
  17687. 1.3253 0.2464 0.5663 C 0 0 0 0 0 0 0 0 0 0 0 0
  17688. 1.0589 -0.2760 -0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0
  17689. -0.5180 -0.8495 -2.0403 H 0 0 0 0 0 0 0 0 0 0 0 0
  17690. -2.3238 -0.2020 -0.4375 H 0 0 0 0 0 0 0 0 0 0 0 0
  17691. -1.6631 0.7247 1.7861 H 0 0 0 0 0 0 0 0 0 0 0 0
  17692. 2.3464 0.3958 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0
  17693. 1.8678 -0.5459 -1.3586 H 0 0 0 0 0 0 0 0 0 0 0 0
  17694. 1 2 2 0
  17695. 2 3 1 0
  17696. 3 4 2 0
  17697. 4 5 1 0
  17698. 5 6 2 0
  17699. 6 1 1 0
  17700. 1 7 1 0
  17701. 2 8 1 0
  17702. 3 9 1 0
  17703. 5 10 1 0
  17704. 6 11 1 0
  17705. M END
  17706. $$$$
  17707. RDKit 3D
  17708. 11 11 0 0 0 0 0 0 0 0999 V2000
  17709. -0.2702 -0.4364 -1.0668 C 0 0 0 0 0 0 0 0 0 0 0 0
  17710. -1.2785 -0.0831 -0.1762 C 0 0 0 0 0 0 0 0 0 0 0 0
  17711. -0.9129 0.4233 1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
  17712. 0.3682 0.5946 1.4538 N 0 0 0 0 0 0 0 0 0 0 0 0
  17713. 1.3253 0.2428 0.5678 C 0 0 0 0 0 0 0 0 0 0 0 0
  17714. 1.0589 -0.2716 -0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0
  17715. -0.5180 -0.8367 -2.0456 H 0 0 0 0 0 0 0 0 0 0 0 0
  17716. -2.3238 -0.1993 -0.4388 H 0 0 0 0 0 0 0 0 0 0 0 0
  17717. -1.6631 0.7135 1.7906 H 0 0 0 0 0 0 0 0 0 0 0 0
  17718. 2.3464 0.3901 0.9075 H 0 0 0 0 0 0 0 0 0 0 0 0
  17719. 1.8678 -0.5373 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0
  17720. 1 2 2 0
  17721. 2 3 1 0
  17722. 3 4 2 0
  17723. 4 5 1 0
  17724. 5 6 2 0
  17725. 6 1 1 0
  17726. 1 7 1 0
  17727. 2 8 1 0
  17728. 3 9 1 0
  17729. 5 10 1 0
  17730. 6 11 1 0
  17731. M END
  17732. $$$$
  17733. RDKit 3D
  17734. 11 11 0 0 0 0 0 0 0 0999 V2000
  17735. -0.2702 -0.4297 -1.0696 C 0 0 0 0 0 0 0 0 0 0 0 0
  17736. -1.2785 -0.0820 -0.1768 C 0 0 0 0 0 0 0 0 0 0 0 0
  17737. -0.9129 0.4167 1.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
  17738. 0.3682 0.5855 1.4575 N 0 0 0 0 0 0 0 0 0 0 0 0
  17739. 1.3253 0.2392 0.5693 C 0 0 0 0 0 0 0 0 0 0 0 0
  17740. 1.0589 -0.2673 -0.6928 C 0 0 0 0 0 0 0 0 0 0 0 0
  17741. -0.5180 -0.8238 -2.0508 H 0 0 0 0 0 0 0 0 0 0 0 0
  17742. -2.3238 -0.1965 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  17743. -1.6631 0.7022 1.7951 H 0 0 0 0 0 0 0 0 0 0 0 0
  17744. 2.3464 0.3844 0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0
  17745. 1.8678 -0.5287 -1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0
  17746. 1 2 2 0
  17747. 2 3 1 0
  17748. 3 4 2 0
  17749. 4 5 1 0
  17750. 5 6 2 0
  17751. 6 1 1 0
  17752. 1 7 1 0
  17753. 2 8 1 0
  17754. 3 9 1 0
  17755. 5 10 1 0
  17756. 6 11 1 0
  17757. M END
  17758. $$$$
  17759. RDKit 3D
  17760. 11 11 0 0 0 0 0 0 0 0999 V2000
  17761. -0.2702 -0.4229 -1.0722 C 0 0 0 0 0 0 0 0 0 0 0 0
  17762. -1.2785 -0.0809 -0.1773 C 0 0 0 0 0 0 0 0 0 0 0 0
  17763. -0.9129 0.4100 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0
  17764. 0.3682 0.5763 1.4612 N 0 0 0 0 0 0 0 0 0 0 0 0
  17765. 1.3253 0.2357 0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0
  17766. 1.0589 -0.2629 -0.6944 C 0 0 0 0 0 0 0 0 0 0 0 0
  17767. -0.5180 -0.8109 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  17768. -2.3238 -0.1937 -0.4412 H 0 0 0 0 0 0 0 0 0 0 0 0
  17769. -1.6631 0.6909 1.7995 H 0 0 0 0 0 0 0 0 0 0 0 0
  17770. 2.3464 0.3787 0.9123 H 0 0 0 0 0 0 0 0 0 0 0 0
  17771. 1.8678 -0.5202 -1.3687 H 0 0 0 0 0 0 0 0 0 0 0 0
  17772. 1 2 2 0
  17773. 2 3 1 0
  17774. 3 4 2 0
  17775. 4 5 1 0
  17776. 5 6 2 0
  17777. 6 1 1 0
  17778. 1 7 1 0
  17779. 2 8 1 0
  17780. 3 9 1 0
  17781. 5 10 1 0
  17782. 6 11 1 0
  17783. M END
  17784. $$$$
  17785. RDKit 3D
  17786. 11 11 0 0 0 0 0 0 0 0999 V2000
  17787. -0.2702 -0.4162 -1.0749 C 0 0 0 0 0 0 0 0 0 0 0 0
  17788. -1.2785 -0.0798 -0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
  17789. -0.9129 0.4033 1.0686 C 0 0 0 0 0 0 0 0 0 0 0 0
  17790. 0.3682 0.5671 1.4648 N 0 0 0 0 0 0 0 0 0 0 0 0
  17791. 1.3253 0.2321 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0
  17792. 1.0589 -0.2586 -0.6961 C 0 0 0 0 0 0 0 0 0 0 0 0
  17793. -0.5180 -0.7980 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  17794. -2.3238 -0.1909 -0.4425 H 0 0 0 0 0 0 0 0 0 0 0 0
  17795. -1.6631 0.6796 1.8038 H 0 0 0 0 0 0 0 0 0 0 0 0
  17796. 2.3464 0.3729 0.9147 H 0 0 0 0 0 0 0 0 0 0 0 0
  17797. 1.8678 -0.5115 -1.3719 H 0 0 0 0 0 0 0 0 0 0 0 0
  17798. 1 2 2 0
  17799. 2 3 1 0
  17800. 3 4 2 0
  17801. 4 5 1 0
  17802. 5 6 2 0
  17803. 6 1 1 0
  17804. 1 7 1 0
  17805. 2 8 1 0
  17806. 3 9 1 0
  17807. 5 10 1 0
  17808. 6 11 1 0
  17809. M END
  17810. $$$$
  17811. RDKit 3D
  17812. 11 11 0 0 0 0 0 0 0 0999 V2000
  17813. -0.2702 -0.4094 -1.0775 C 0 0 0 0 0 0 0 0 0 0 0 0
  17814. -1.2785 -0.0787 -0.1783 C 0 0 0 0 0 0 0 0 0 0 0 0
  17815. -0.9129 0.3965 1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0
  17816. 0.3682 0.5579 1.4683 N 0 0 0 0 0 0 0 0 0 0 0 0
  17817. 1.3253 0.2285 0.5737 C 0 0 0 0 0 0 0 0 0 0 0 0
  17818. 1.0589 -0.2542 -0.6977 C 0 0 0 0 0 0 0 0 0 0 0 0
  17819. -0.5180 -0.7850 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
  17820. -2.3238 -0.1882 -0.4436 H 0 0 0 0 0 0 0 0 0 0 0 0
  17821. -1.6631 0.6683 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0
  17822. 2.3464 0.3672 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
  17823. 1.8678 -0.5029 -1.3751 H 0 0 0 0 0 0 0 0 0 0 0 0
  17824. 1 2 2 0
  17825. 2 3 1 0
  17826. 3 4 2 0
  17827. 4 5 1 0
  17828. 5 6 2 0
  17829. 6 1 1 0
  17830. 1 7 1 0
  17831. 2 8 1 0
  17832. 3 9 1 0
  17833. 5 10 1 0
  17834. 6 11 1 0
  17835. M END
  17836. $$$$
  17837. RDKit 3D
  17838. 11 11 0 0 0 0 0 0 0 0999 V2000
  17839. -0.2702 -0.4026 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  17840. -1.2785 -0.0775 -0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0
  17841. -0.9129 0.3898 1.0736 C 0 0 0 0 0 0 0 0 0 0 0 0
  17842. 0.3682 0.5487 1.4718 N 0 0 0 0 0 0 0 0 0 0 0 0
  17843. 1.3253 0.2249 0.5752 C 0 0 0 0 0 0 0 0 0 0 0 0
  17844. 1.0589 -0.2498 -0.6993 C 0 0 0 0 0 0 0 0 0 0 0 0
  17845. -0.5180 -0.7720 -2.0709 H 0 0 0 0 0 0 0 0 0 0 0 0
  17846. -2.3238 -0.1854 -0.4448 H 0 0 0 0 0 0 0 0 0 0 0 0
  17847. -1.6631 0.6569 1.8122 H 0 0 0 0 0 0 0 0 0 0 0 0
  17848. 2.3464 0.3614 0.9193 H 0 0 0 0 0 0 0 0 0 0 0 0
  17849. 1.8678 -0.4943 -1.3782 H 0 0 0 0 0 0 0 0 0 0 0 0
  17850. 1 2 2 0
  17851. 2 3 1 0
  17852. 3 4 2 0
  17853. 4 5 1 0
  17854. 5 6 2 0
  17855. 6 1 1 0
  17856. 1 7 1 0
  17857. 2 8 1 0
  17858. 3 9 1 0
  17859. 5 10 1 0
  17860. 6 11 1 0
  17861. M END
  17862. $$$$
  17863. RDKit 3D
  17864. 11 11 0 0 0 0 0 0 0 0999 V2000
  17865. -0.2702 -0.3958 -1.0825 C 0 0 0 0 0 0 0 0 0 0 0 0
  17866. -1.2785 -0.0764 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0
  17867. -0.9129 0.3830 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0
  17868. 0.3682 0.5394 1.4752 N 0 0 0 0 0 0 0 0 0 0 0 0
  17869. 1.3253 0.2212 0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0
  17870. 1.0589 -0.2454 -0.7008 C 0 0 0 0 0 0 0 0 0 0 0 0
  17871. -0.5180 -0.7590 -2.0757 H 0 0 0 0 0 0 0 0 0 0 0 0
  17872. -2.3238 -0.1826 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  17873. -1.6631 0.6455 1.8162 H 0 0 0 0 0 0 0 0 0 0 0 0
  17874. 2.3464 0.3556 0.9215 H 0 0 0 0 0 0 0 0 0 0 0 0
  17875. 1.8678 -0.4856 -1.3813 H 0 0 0 0 0 0 0 0 0 0 0 0
  17876. 1 2 2 0
  17877. 2 3 1 0
  17878. 3 4 2 0
  17879. 4 5 1 0
  17880. 5 6 2 0
  17881. 6 1 1 0
  17882. 1 7 1 0
  17883. 2 8 1 0
  17884. 3 9 1 0
  17885. 5 10 1 0
  17886. 6 11 1 0
  17887. M END
  17888. $$$$
  17889. RDKit 3D
  17890. 11 11 0 0 0 0 0 0 0 0999 V2000
  17891. -0.2702 -0.3890 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  17892. -1.2785 -0.0753 -0.1797 C 0 0 0 0 0 0 0 0 0 0 0 0
  17893. -0.9129 0.3763 1.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
  17894. 0.3682 0.5301 1.4786 N 0 0 0 0 0 0 0 0 0 0 0 0
  17895. 1.3253 0.2176 0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0
  17896. 1.0589 -0.2410 -0.7023 C 0 0 0 0 0 0 0 0 0 0 0 0
  17897. -0.5180 -0.7460 -2.0804 H 0 0 0 0 0 0 0 0 0 0 0 0
  17898. -2.3238 -0.1798 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0
  17899. -1.6631 0.6341 1.8203 H 0 0 0 0 0 0 0 0 0 0 0 0
  17900. 2.3464 0.3498 0.9238 H 0 0 0 0 0 0 0 0 0 0 0 0
  17901. 1.8678 -0.4769 -1.3843 H 0 0 0 0 0 0 0 0 0 0 0 0
  17902. 1 2 2 0
  17903. 2 3 1 0
  17904. 3 4 2 0
  17905. 4 5 1 0
  17906. 5 6 2 0
  17907. 6 1 1 0
  17908. 1 7 1 0
  17909. 2 8 1 0
  17910. 3 9 1 0
  17911. 5 10 1 0
  17912. 6 11 1 0
  17913. M END
  17914. $$$$
  17915. RDKit 3D
  17916. 11 11 0 0 0 0 0 0 0 0999 V2000
  17917. -0.2702 -0.3822 -1.0874 C 0 0 0 0 0 0 0 0 0 0 0 0
  17918. -1.2785 -0.0742 -0.1802 C 0 0 0 0 0 0 0 0 0 0 0 0
  17919. -0.9129 0.3695 1.0807 C 0 0 0 0 0 0 0 0 0 0 0 0
  17920. 0.3682 0.5208 1.4819 N 0 0 0 0 0 0 0 0 0 0 0 0
  17921. 1.3253 0.2140 0.5793 C 0 0 0 0 0 0 0 0 0 0 0 0
  17922. 1.0589 -0.2366 -0.7039 C 0 0 0 0 0 0 0 0 0 0 0 0
  17923. -0.5180 -0.7329 -2.0851 H 0 0 0 0 0 0 0 0 0 0 0 0
  17924. -2.3238 -0.1770 -0.4482 H 0 0 0 0 0 0 0 0 0 0 0 0
  17925. -1.6631 0.6226 1.8242 H 0 0 0 0 0 0 0 0 0 0 0 0
  17926. 2.3464 0.3440 0.9259 H 0 0 0 0 0 0 0 0 0 0 0 0
  17927. 1.8678 -0.4682 -1.3873 H 0 0 0 0 0 0 0 0 0 0 0 0
  17928. 1 2 2 0
  17929. 2 3 1 0
  17930. 3 4 2 0
  17931. 4 5 1 0
  17932. 5 6 2 0
  17933. 6 1 1 0
  17934. 1 7 1 0
  17935. 2 8 1 0
  17936. 3 9 1 0
  17937. 5 10 1 0
  17938. 6 11 1 0
  17939. M END
  17940. $$$$
  17941. RDKit 3D
  17942. 11 11 0 0 0 0 0 0 0 0999 V2000
  17943. -0.2702 -0.3754 -1.0898 C 0 0 0 0 0 0 0 0 0 0 0 0
  17944. -1.2785 -0.0730 -0.1807 C 0 0 0 0 0 0 0 0 0 0 0 0
  17945. -0.9129 0.3627 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
  17946. 0.3682 0.5115 1.4851 N 0 0 0 0 0 0 0 0 0 0 0 0
  17947. 1.3253 0.2103 0.5806 C 0 0 0 0 0 0 0 0 0 0 0 0
  17948. 1.0589 -0.2321 -0.7053 C 0 0 0 0 0 0 0 0 0 0 0 0
  17949. -0.5180 -0.7198 -2.0896 H 0 0 0 0 0 0 0 0 0 0 0 0
  17950. -2.3238 -0.1741 -0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0
  17951. -1.6631 0.6111 1.8281 H 0 0 0 0 0 0 0 0 0 0 0 0
  17952. 2.3464 0.3382 0.9281 H 0 0 0 0 0 0 0 0 0 0 0 0
  17953. 1.8678 -0.4595 -1.3902 H 0 0 0 0 0 0 0 0 0 0 0 0
  17954. 1 2 2 0
  17955. 2 3 1 0
  17956. 3 4 2 0
  17957. 4 5 1 0
  17958. 5 6 2 0
  17959. 6 1 1 0
  17960. 1 7 1 0
  17961. 2 8 1 0
  17962. 3 9 1 0
  17963. 5 10 1 0
  17964. 6 11 1 0
  17965. M END
  17966. $$$$
  17967. RDKit 3D
  17968. 11 11 0 0 0 0 0 0 0 0999 V2000
  17969. -0.2702 -0.3685 -1.0921 C 0 0 0 0 0 0 0 0 0 0 0 0
  17970. -1.2785 -0.0719 -0.1811 C 0 0 0 0 0 0 0 0 0 0 0 0
  17971. -0.9129 0.3559 1.0853 C 0 0 0 0 0 0 0 0 0 0 0 0
  17972. 0.3682 0.5022 1.4883 N 0 0 0 0 0 0 0 0 0 0 0 0
  17973. 1.3253 0.2067 0.5819 C 0 0 0 0 0 0 0 0 0 0 0 0
  17974. 1.0589 -0.2277 -0.7068 C 0 0 0 0 0 0 0 0 0 0 0 0
  17975. -0.5180 -0.7066 -2.0941 H 0 0 0 0 0 0 0 0 0 0 0 0
  17976. -2.3238 -0.1713 -0.4504 H 0 0 0 0 0 0 0 0 0 0 0 0
  17977. -1.6631 0.5996 1.8319 H 0 0 0 0 0 0 0 0 0 0 0 0
  17978. 2.3464 0.3324 0.9302 H 0 0 0 0 0 0 0 0 0 0 0 0
  17979. 1.8678 -0.4507 -1.3931 H 0 0 0 0 0 0 0 0 0 0 0 0
  17980. 1 2 2 0
  17981. 2 3 1 0
  17982. 3 4 2 0
  17983. 4 5 1 0
  17984. 5 6 2 0
  17985. 6 1 1 0
  17986. 1 7 1 0
  17987. 2 8 1 0
  17988. 3 9 1 0
  17989. 5 10 1 0
  17990. 6 11 1 0
  17991. M END
  17992. $$$$
  17993. RDKit 3D
  17994. 11 11 0 0 0 0 0 0 0 0999 V2000
  17995. -0.2702 -0.3616 -1.0944 C 0 0 0 0 0 0 0 0 0 0 0 0
  17996. -1.2785 -0.0707 -0.1816 C 0 0 0 0 0 0 0 0 0 0 0 0
  17997. -0.9129 0.3491 1.0875 C 0 0 0 0 0 0 0 0 0 0 0 0
  17998. 0.3682 0.4928 1.4914 N 0 0 0 0 0 0 0 0 0 0 0 0
  17999. 1.3253 0.2030 0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0
  18000. 1.0589 -0.2233 -0.7082 C 0 0 0 0 0 0 0 0 0 0 0 0
  18001. -0.5180 -0.6934 -2.0985 H 0 0 0 0 0 0 0 0 0 0 0 0
  18002. -2.3238 -0.1685 -0.4515 H 0 0 0 0 0 0 0 0 0 0 0 0
  18003. -1.6631 0.5881 1.8356 H 0 0 0 0 0 0 0 0 0 0 0 0
  18004. 2.3464 0.3265 0.9323 H 0 0 0 0 0 0 0 0 0 0 0 0
  18005. 1.8678 -0.4420 -1.3959 H 0 0 0 0 0 0 0 0 0 0 0 0
  18006. 1 2 2 0
  18007. 2 3 1 0
  18008. 3 4 2 0
  18009. 4 5 1 0
  18010. 5 6 2 0
  18011. 6 1 1 0
  18012. 1 7 1 0
  18013. 2 8 1 0
  18014. 3 9 1 0
  18015. 5 10 1 0
  18016. 6 11 1 0
  18017. M END
  18018. $$$$
  18019. RDKit 3D
  18020. 11 11 0 0 0 0 0 0 0 0999 V2000
  18021. -0.2702 -0.3548 -1.0967 C 0 0 0 0 0 0 0 0 0 0 0 0
  18022. -1.2785 -0.0696 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0
  18023. -0.9129 0.3422 1.0897 C 0 0 0 0 0 0 0 0 0 0 0 0
  18024. 0.3682 0.4834 1.4945 N 0 0 0 0 0 0 0 0 0 0 0 0
  18025. 1.3253 0.1994 0.5845 C 0 0 0 0 0 0 0 0 0 0 0 0
  18026. 1.0589 -0.2188 -0.7096 C 0 0 0 0 0 0 0 0 0 0 0 0
  18027. -0.5180 -0.6802 -2.1028 H 0 0 0 0 0 0 0 0 0 0 0 0
  18028. -2.3238 -0.1656 -0.4525 H 0 0 0 0 0 0 0 0 0 0 0 0
  18029. -1.6631 0.5766 1.8393 H 0 0 0 0 0 0 0 0 0 0 0 0
  18030. 2.3464 0.3206 0.9343 H 0 0 0 0 0 0 0 0 0 0 0 0
  18031. 1.8678 -0.4332 -1.3986 H 0 0 0 0 0 0 0 0 0 0 0 0
  18032. 1 2 2 0
  18033. 2 3 1 0
  18034. 3 4 2 0
  18035. 4 5 1 0
  18036. 5 6 2 0
  18037. 6 1 1 0
  18038. 1 7 1 0
  18039. 2 8 1 0
  18040. 3 9 1 0
  18041. 5 10 1 0
  18042. 6 11 1 0
  18043. M END
  18044. $$$$
  18045. RDKit 3D
  18046. 11 11 0 0 0 0 0 0 0 0999 V2000
  18047. -0.2702 -0.3479 -1.0989 C 0 0 0 0 0 0 0 0 0 0 0 0
  18048. -1.2785 -0.0685 -0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0
  18049. -0.9129 0.3354 1.0918 C 0 0 0 0 0 0 0 0 0 0 0 0
  18050. 0.3682 0.4740 1.4975 N 0 0 0 0 0 0 0 0 0 0 0 0
  18051. 1.3253 0.1957 0.5857 C 0 0 0 0 0 0 0 0 0 0 0 0
  18052. 1.0589 -0.2143 -0.7109 C 0 0 0 0 0 0 0 0 0 0 0 0
  18053. -0.5180 -0.6670 -2.1071 H 0 0 0 0 0 0 0 0 0 0 0 0
  18054. -2.3238 -0.1628 -0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0
  18055. -1.6631 0.5650 1.8429 H 0 0 0 0 0 0 0 0 0 0 0 0
  18056. 2.3464 0.3148 0.9363 H 0 0 0 0 0 0 0 0 0 0 0 0
  18057. 1.8678 -0.4244 -1.4013 H 0 0 0 0 0 0 0 0 0 0 0 0
  18058. 1 2 2 0
  18059. 2 3 1 0
  18060. 3 4 2 0
  18061. 4 5 1 0
  18062. 5 6 2 0
  18063. 6 1 1 0
  18064. 1 7 1 0
  18065. 2 8 1 0
  18066. 3 9 1 0
  18067. 5 10 1 0
  18068. 6 11 1 0
  18069. M END
  18070. $$$$
  18071. RDKit 3D
  18072. 11 11 0 0 0 0 0 0 0 0999 V2000
  18073. -0.2702 -0.3410 -1.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
  18074. -1.2785 -0.0673 -0.1829 C 0 0 0 0 0 0 0 0 0 0 0 0
  18075. -0.9129 0.3285 1.0939 C 0 0 0 0 0 0 0 0 0 0 0 0
  18076. 0.3682 0.4646 1.5004 N 0 0 0 0 0 0 0 0 0 0 0 0
  18077. 1.3253 0.1920 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0
  18078. 1.0589 -0.2099 -0.7123 C 0 0 0 0 0 0 0 0 0 0 0 0
  18079. -0.5180 -0.6538 -2.1112 H 0 0 0 0 0 0 0 0 0 0 0 0
  18080. -2.3238 -0.1599 -0.4546 H 0 0 0 0 0 0 0 0 0 0 0 0
  18081. -1.6631 0.5534 1.8464 H 0 0 0 0 0 0 0 0 0 0 0 0
  18082. 2.3464 0.3089 0.9383 H 0 0 0 0 0 0 0 0 0 0 0 0
  18083. 1.8678 -0.4156 -1.4039 H 0 0 0 0 0 0 0 0 0 0 0 0
  18084. 1 2 2 0
  18085. 2 3 1 0
  18086. 3 4 2 0
  18087. 4 5 1 0
  18088. 5 6 2 0
  18089. 6 1 1 0
  18090. 1 7 1 0
  18091. 2 8 1 0
  18092. 3 9 1 0
  18093. 5 10 1 0
  18094. 6 11 1 0
  18095. M END
  18096. $$$$
  18097. RDKit 3D
  18098. 11 11 0 0 0 0 0 0 0 0999 V2000
  18099. -0.2702 -0.3340 -1.1032 C 0 0 0 0 0 0 0 0 0 0 0 0
  18100. -1.2785 -0.0662 -0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0
  18101. -0.9129 0.3216 1.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
  18102. 0.3682 0.4552 1.5033 N 0 0 0 0 0 0 0 0 0 0 0 0
  18103. 1.3253 0.1883 0.5882 C 0 0 0 0 0 0 0 0 0 0 0 0
  18104. 1.0589 -0.2054 -0.7136 C 0 0 0 0 0 0 0 0 0 0 0 0
  18105. -0.5180 -0.6405 -2.1153 H 0 0 0 0 0 0 0 0 0 0 0 0
  18106. -2.3238 -0.1571 -0.4556 H 0 0 0 0 0 0 0 0 0 0 0 0
  18107. -1.6631 0.5418 1.8498 H 0 0 0 0 0 0 0 0 0 0 0 0
  18108. 2.3464 0.3030 0.9402 H 0 0 0 0 0 0 0 0 0 0 0 0
  18109. 1.8678 -0.4068 -1.4065 H 0 0 0 0 0 0 0 0 0 0 0 0
  18110. 1 2 2 0
  18111. 2 3 1 0
  18112. 3 4 2 0
  18113. 4 5 1 0
  18114. 5 6 2 0
  18115. 6 1 1 0
  18116. 1 7 1 0
  18117. 2 8 1 0
  18118. 3 9 1 0
  18119. 5 10 1 0
  18120. 6 11 1 0
  18121. M END
  18122. $$$$
  18123. RDKit 3D
  18124. 11 11 0 0 0 0 0 0 0 0999 V2000
  18125. -0.2702 -0.3271 -1.1053 C 0 0 0 0 0 0 0 0 0 0 0 0
  18126. -1.2785 -0.0650 -0.1837 C 0 0 0 0 0 0 0 0 0 0 0 0
  18127. -0.9129 0.3147 1.0979 C 0 0 0 0 0 0 0 0 0 0 0 0
  18128. 0.3682 0.4457 1.5062 N 0 0 0 0 0 0 0 0 0 0 0 0
  18129. 1.3253 0.1846 0.5893 C 0 0 0 0 0 0 0 0 0 0 0 0
  18130. 1.0589 -0.2009 -0.7148 C 0 0 0 0 0 0 0 0 0 0 0 0
  18131. -0.5180 -0.6272 -2.1192 H 0 0 0 0 0 0 0 0 0 0 0 0
  18132. -2.3238 -0.1542 -0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
  18133. -1.6631 0.5302 1.8532 H 0 0 0 0 0 0 0 0 0 0 0 0
  18134. 2.3464 0.2971 0.9421 H 0 0 0 0 0 0 0 0 0 0 0 0
  18135. 1.8678 -0.3979 -1.4091 H 0 0 0 0 0 0 0 0 0 0 0 0
  18136. 1 2 2 0
  18137. 2 3 1 0
  18138. 3 4 2 0
  18139. 4 5 1 0
  18140. 5 6 2 0
  18141. 6 1 1 0
  18142. 1 7 1 0
  18143. 2 8 1 0
  18144. 3 9 1 0
  18145. 5 10 1 0
  18146. 6 11 1 0
  18147. M END
  18148. $$$$
  18149. RDKit 3D
  18150. 11 11 0 0 0 0 0 0 0 0999 V2000
  18151. -0.2702 -0.3201 -1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0
  18152. -1.2785 -0.0639 -0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0
  18153. -0.9129 0.3078 1.0999 C 0 0 0 0 0 0 0 0 0 0 0 0
  18154. 0.3682 0.4363 1.5089 N 0 0 0 0 0 0 0 0 0 0 0 0
  18155. 1.3253 0.1809 0.5905 C 0 0 0 0 0 0 0 0 0 0 0 0
  18156. 1.0589 -0.1964 -0.7161 C 0 0 0 0 0 0 0 0 0 0 0 0
  18157. -0.5180 -0.6138 -2.1231 H 0 0 0 0 0 0 0 0 0 0 0 0
  18158. -2.3238 -0.1513 -0.4575 H 0 0 0 0 0 0 0 0 0 0 0 0
  18159. -1.6631 0.5185 1.8565 H 0 0 0 0 0 0 0 0 0 0 0 0
  18160. 2.3464 0.2911 0.9439 H 0 0 0 0 0 0 0 0 0 0 0 0
  18161. 1.8678 -0.3890 -1.4115 H 0 0 0 0 0 0 0 0 0 0 0 0
  18162. 1 2 2 0
  18163. 2 3 1 0
  18164. 3 4 2 0
  18165. 4 5 1 0
  18166. 5 6 2 0
  18167. 6 1 1 0
  18168. 1 7 1 0
  18169. 2 8 1 0
  18170. 3 9 1 0
  18171. 5 10 1 0
  18172. 6 11 1 0
  18173. M END
  18174. $$$$
  18175. RDKit 3D
  18176. 11 11 0 0 0 0 0 0 0 0999 V2000
  18177. -0.2702 -0.3132 -1.1093 C 0 0 0 0 0 0 0 0 0 0 0 0
  18178. -1.2785 -0.0627 -0.1845 C 0 0 0 0 0 0 0 0 0 0 0 0
  18179. -0.9129 0.3009 1.1018 C 0 0 0 0 0 0 0 0 0 0 0 0
  18180. 0.3682 0.4268 1.5116 N 0 0 0 0 0 0 0 0 0 0 0 0
  18181. 1.3253 0.1772 0.5916 C 0 0 0 0 0 0 0 0 0 0 0 0
  18182. 1.0589 -0.1919 -0.7173 C 0 0 0 0 0 0 0 0 0 0 0 0
  18183. -0.5180 -0.6005 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0
  18184. -2.3238 -0.1485 -0.4585 H 0 0 0 0 0 0 0 0 0 0 0 0
  18185. -1.6631 0.5068 1.8597 H 0 0 0 0 0 0 0 0 0 0 0 0
  18186. 2.3464 0.2852 0.9457 H 0 0 0 0 0 0 0 0 0 0 0 0
  18187. 1.8678 -0.3802 -1.4139 H 0 0 0 0 0 0 0 0 0 0 0 0
  18188. 1 2 2 0
  18189. 2 3 1 0
  18190. 3 4 2 0
  18191. 4 5 1 0
  18192. 5 6 2 0
  18193. 6 1 1 0
  18194. 1 7 1 0
  18195. 2 8 1 0
  18196. 3 9 1 0
  18197. 5 10 1 0
  18198. 6 11 1 0
  18199. M END
  18200. $$$$
  18201. RDKit 3D
  18202. 11 11 0 0 0 0 0 0 0 0999 V2000
  18203. -0.2702 -0.3062 -1.1112 C 0 0 0 0 0 0 0 0 0 0 0 0
  18204. -1.2785 -0.0615 -0.1849 C 0 0 0 0 0 0 0 0 0 0 0 0
  18205. -0.9129 0.2940 1.1037 C 0 0 0 0 0 0 0 0 0 0 0 0
  18206. 0.3682 0.4173 1.5143 N 0 0 0 0 0 0 0 0 0 0 0 0
  18207. 1.3253 0.1735 0.5927 C 0 0 0 0 0 0 0 0 0 0 0 0
  18208. 1.0589 -0.1874 -0.7185 C 0 0 0 0 0 0 0 0 0 0 0 0
  18209. -0.5180 -0.5871 -2.1307 H 0 0 0 0 0 0 0 0 0 0 0 0
  18210. -2.3238 -0.1456 -0.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
  18211. -1.6631 0.4951 1.8629 H 0 0 0 0 0 0 0 0 0 0 0 0
  18212. 2.3464 0.2793 0.9475 H 0 0 0 0 0 0 0 0 0 0 0 0
  18213. 1.8678 -0.3713 -1.4163 H 0 0 0 0 0 0 0 0 0 0 0 0
  18214. 1 2 2 0
  18215. 2 3 1 0
  18216. 3 4 2 0
  18217. 4 5 1 0
  18218. 5 6 2 0
  18219. 6 1 1 0
  18220. 1 7 1 0
  18221. 2 8 1 0
  18222. 3 9 1 0
  18223. 5 10 1 0
  18224. 6 11 1 0
  18225. M END
  18226. $$$$
  18227. RDKit 3D
  18228. 11 11 0 0 0 0 0 0 0 0999 V2000
  18229. -0.2702 -0.2992 -1.1131 C 0 0 0 0 0 0 0 0 0 0 0 0
  18230. -1.2785 -0.0604 -0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0
  18231. -0.9129 0.2870 1.1055 C 0 0 0 0 0 0 0 0 0 0 0 0
  18232. 0.3682 0.4077 1.5169 N 0 0 0 0 0 0 0 0 0 0 0 0
  18233. 1.3253 0.1697 0.5938 C 0 0 0 0 0 0 0 0 0 0 0 0
  18234. 1.0589 -0.1829 -0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0
  18235. -0.5180 -0.5737 -2.1343 H 0 0 0 0 0 0 0 0 0 0 0 0
  18236. -2.3238 -0.1427 -0.4603 H 0 0 0 0 0 0 0 0 0 0 0 0
  18237. -1.6631 0.4834 1.8659 H 0 0 0 0 0 0 0 0 0 0 0 0
  18238. 2.3464 0.2733 0.9492 H 0 0 0 0 0 0 0 0 0 0 0 0
  18239. 1.8678 -0.3624 -1.4186 H 0 0 0 0 0 0 0 0 0 0 0 0
  18240. 1 2 2 0
  18241. 2 3 1 0
  18242. 3 4 2 0
  18243. 4 5 1 0
  18244. 5 6 2 0
  18245. 6 1 1 0
  18246. 1 7 1 0
  18247. 2 8 1 0
  18248. 3 9 1 0
  18249. 5 10 1 0
  18250. 6 11 1 0
  18251. M END
  18252. $$$$
  18253. RDKit 3D
  18254. 11 11 0 0 0 0 0 0 0 0999 V2000
  18255. -0.2702 -0.2922 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0
  18256. -1.2785 -0.0592 -0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0
  18257. -0.9129 0.2801 1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0
  18258. 0.3682 0.3982 1.5194 N 0 0 0 0 0 0 0 0 0 0 0 0
  18259. 1.3253 0.1660 0.5948 C 0 0 0 0 0 0 0 0 0 0 0 0
  18260. 1.0589 -0.1784 -0.7208 C 0 0 0 0 0 0 0 0 0 0 0 0
  18261. -0.5180 -0.5603 -2.1379 H 0 0 0 0 0 0 0 0 0 0 0 0
  18262. -2.3238 -0.1398 -0.4612 H 0 0 0 0 0 0 0 0 0 0 0 0
  18263. -1.6631 0.4717 1.8689 H 0 0 0 0 0 0 0 0 0 0 0 0
  18264. 2.3464 0.2673 0.9509 H 0 0 0 0 0 0 0 0 0 0 0 0
  18265. 1.8678 -0.3535 -1.4209 H 0 0 0 0 0 0 0 0 0 0 0 0
  18266. 1 2 2 0
  18267. 2 3 1 0
  18268. 3 4 2 0
  18269. 4 5 1 0
  18270. 5 6 2 0
  18271. 6 1 1 0
  18272. 1 7 1 0
  18273. 2 8 1 0
  18274. 3 9 1 0
  18275. 5 10 1 0
  18276. 6 11 1 0
  18277. M END
  18278. $$$$
  18279. RDKit 3D
  18280. 11 11 0 0 0 0 0 0 0 0999 V2000
  18281. -0.2702 -0.2852 -1.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
  18282. -1.2785 -0.0580 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  18283. -0.9129 0.2731 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0
  18284. 0.3682 0.3887 1.5219 N 0 0 0 0 0 0 0 0 0 0 0 0
  18285. 1.3253 0.1623 0.5959 C 0 0 0 0 0 0 0 0 0 0 0 0
  18286. 1.0589 -0.1738 -0.7219 C 0 0 0 0 0 0 0 0 0 0 0 0
  18287. -0.5180 -0.5469 -2.1414 H 0 0 0 0 0 0 0 0 0 0 0 0
  18288. -2.3238 -0.1369 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0
  18289. -1.6631 0.4599 1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0
  18290. 2.3464 0.2613 0.9526 H 0 0 0 0 0 0 0 0 0 0 0 0
  18291. 1.8678 -0.3445 -1.4231 H 0 0 0 0 0 0 0 0 0 0 0 0
  18292. 1 2 2 0
  18293. 2 3 1 0
  18294. 3 4 2 0
  18295. 4 5 1 0
  18296. 5 6 2 0
  18297. 6 1 1 0
  18298. 1 7 1 0
  18299. 2 8 1 0
  18300. 3 9 1 0
  18301. 5 10 1 0
  18302. 6 11 1 0
  18303. M END
  18304. $$$$
  18305. RDKit 3D
  18306. 11 11 0 0 0 0 0 0 0 0999 V2000
  18307. -0.2702 -0.2782 -1.1186 C 0 0 0 0 0 0 0 0 0 0 0 0
  18308. -1.2785 -0.0569 -0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0
  18309. -0.9129 0.2662 1.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
  18310. 0.3682 0.3791 1.5243 N 0 0 0 0 0 0 0 0 0 0 0 0
  18311. 1.3253 0.1585 0.5969 C 0 0 0 0 0 0 0 0 0 0 0 0
  18312. 1.0589 -0.1693 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0
  18313. -0.5180 -0.5334 -2.1448 H 0 0 0 0 0 0 0 0 0 0 0 0
  18314. -2.3238 -0.1340 -0.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
  18315. -1.6631 0.4482 1.8747 H 0 0 0 0 0 0 0 0 0 0 0 0
  18316. 2.3464 0.2554 0.9542 H 0 0 0 0 0 0 0 0 0 0 0 0
  18317. 1.8678 -0.3356 -1.4252 H 0 0 0 0 0 0 0 0 0 0 0 0
  18318. 1 2 2 0
  18319. 2 3 1 0
  18320. 3 4 2 0
  18321. 4 5 1 0
  18322. 5 6 2 0
  18323. 6 1 1 0
  18324. 1 7 1 0
  18325. 2 8 1 0
  18326. 3 9 1 0
  18327. 5 10 1 0
  18328. 6 11 1 0
  18329. M END
  18330. $$$$
  18331. RDKit 3D
  18332. 11 11 0 0 0 0 0 0 0 0999 V2000
  18333. -0.2702 -0.2711 -1.1203 C 0 0 0 0 0 0 0 0 0 0 0 0
  18334. -1.2785 -0.0557 -0.1867 C 0 0 0 0 0 0 0 0 0 0 0 0
  18335. -0.9129 0.2592 1.1124 C 0 0 0 0 0 0 0 0 0 0 0 0
  18336. 0.3682 0.3695 1.5266 N 0 0 0 0 0 0 0 0 0 0 0 0
  18337. 1.3253 0.1548 0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0
  18338. 1.0589 -0.1647 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0
  18339. -0.5180 -0.5199 -2.1481 H 0 0 0 0 0 0 0 0 0 0 0 0
  18340. -2.3238 -0.1311 -0.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  18341. -1.6631 0.4364 1.8775 H 0 0 0 0 0 0 0 0 0 0 0 0
  18342. 2.3464 0.2494 0.9558 H 0 0 0 0 0 0 0 0 0 0 0 0
  18343. 1.8678 -0.3266 -1.4273 H 0 0 0 0 0 0 0 0 0 0 0 0
  18344. 1 2 2 0
  18345. 2 3 1 0
  18346. 3 4 2 0
  18347. 4 5 1 0
  18348. 5 6 2 0
  18349. 6 1 1 0
  18350. 1 7 1 0
  18351. 2 8 1 0
  18352. 3 9 1 0
  18353. 5 10 1 0
  18354. 6 11 1 0
  18355. M END
  18356. $$$$
  18357. RDKit 3D
  18358. 11 11 0 0 0 0 0 0 0 0999 V2000
  18359. -0.2702 -0.2641 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0
  18360. -1.2785 -0.0545 -0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0
  18361. -0.9129 0.2522 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0
  18362. 0.3682 0.3599 1.5289 N 0 0 0 0 0 0 0 0 0 0 0 0
  18363. 1.3253 0.1510 0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0
  18364. 1.0589 -0.1602 -0.7251 C 0 0 0 0 0 0 0 0 0 0 0 0
  18365. -0.5180 -0.5064 -2.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
  18366. -2.3238 -0.1282 -0.4645 H 0 0 0 0 0 0 0 0 0 0 0 0
  18367. -1.6631 0.4246 1.8802 H 0 0 0 0 0 0 0 0 0 0 0 0
  18368. 2.3464 0.2433 0.9573 H 0 0 0 0 0 0 0 0 0 0 0 0
  18369. 1.8678 -0.3176 -1.4293 H 0 0 0 0 0 0 0 0 0 0 0 0
  18370. 1 2 2 0
  18371. 2 3 1 0
  18372. 3 4 2 0
  18373. 4 5 1 0
  18374. 5 6 2 0
  18375. 6 1 1 0
  18376. 1 7 1 0
  18377. 2 8 1 0
  18378. 3 9 1 0
  18379. 5 10 1 0
  18380. 6 11 1 0
  18381. M END
  18382. $$$$
  18383. RDKit 3D
  18384. 11 11 0 0 0 0 0 0 0 0999 V2000
  18385. -0.2702 -0.2570 -1.1236 C 0 0 0 0 0 0 0 0 0 0 0 0
  18386. -1.2785 -0.0533 -0.1874 C 0 0 0 0 0 0 0 0 0 0 0 0
  18387. -0.9129 0.2452 1.1155 C 0 0 0 0 0 0 0 0 0 0 0 0
  18388. 0.3682 0.3503 1.5312 N 0 0 0 0 0 0 0 0 0 0 0 0
  18389. 1.3253 0.1472 0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0
  18390. 1.0589 -0.1556 -0.7261 C 0 0 0 0 0 0 0 0 0 0 0 0
  18391. -0.5180 -0.4929 -2.1544 H 0 0 0 0 0 0 0 0 0 0 0 0
  18392. -2.3238 -0.1252 -0.4653 H 0 0 0 0 0 0 0 0 0 0 0 0
  18393. -1.6631 0.4128 1.8828 H 0 0 0 0 0 0 0 0 0 0 0 0
  18394. 2.3464 0.2373 0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0
  18395. 1.8678 -0.3086 -1.4313 H 0 0 0 0 0 0 0 0 0 0 0 0
  18396. 1 2 2 0
  18397. 2 3 1 0
  18398. 3 4 2 0
  18399. 4 5 1 0
  18400. 5 6 2 0
  18401. 6 1 1 0
  18402. 1 7 1 0
  18403. 2 8 1 0
  18404. 3 9 1 0
  18405. 5 10 1 0
  18406. 6 11 1 0
  18407. M END
  18408. $$$$
  18409. RDKit 3D
  18410. 11 11 0 0 0 0 0 0 0 0999 V2000
  18411. -0.2702 -0.2500 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
  18412. -1.2785 -0.0522 -0.1877 C 0 0 0 0 0 0 0 0 0 0 0 0
  18413. -0.9129 0.2382 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0
  18414. 0.3682 0.3407 1.5333 N 0 0 0 0 0 0 0 0 0 0 0 0
  18415. 1.3253 0.1435 0.6007 C 0 0 0 0 0 0 0 0 0 0 0 0
  18416. 1.0589 -0.1511 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0
  18417. -0.5180 -0.4793 -2.1575 H 0 0 0 0 0 0 0 0 0 0 0 0
  18418. -2.3238 -0.1223 -0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0
  18419. -1.6631 0.4009 1.8854 H 0 0 0 0 0 0 0 0 0 0 0 0
  18420. 2.3464 0.2313 0.9603 H 0 0 0 0 0 0 0 0 0 0 0 0
  18421. 1.8678 -0.2997 -1.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
  18422. 1 2 2 0
  18423. 2 3 1 0
  18424. 3 4 2 0
  18425. 4 5 1 0
  18426. 5 6 2 0
  18427. 6 1 1 0
  18428. 1 7 1 0
  18429. 2 8 1 0
  18430. 3 9 1 0
  18431. 5 10 1 0
  18432. 6 11 1 0
  18433. M END
  18434. $$$$
  18435. RDKit 3D
  18436. 11 11 0 0 0 0 0 0 0 0999 V2000
  18437. -0.2702 -0.2429 -1.1268 C 0 0 0 0 0 0 0 0 0 0 0 0
  18438. -1.2785 -0.0510 -0.1881 C 0 0 0 0 0 0 0 0 0 0 0 0
  18439. -0.9129 0.2311 1.1185 C 0 0 0 0 0 0 0 0 0 0 0 0
  18440. 0.3682 0.3310 1.5355 N 0 0 0 0 0 0 0 0 0 0 0 0
  18441. 1.3253 0.1397 0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0
  18442. 1.0589 -0.1465 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0
  18443. -0.5180 -0.4658 -2.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
  18444. -2.3238 -0.1194 -0.4669 H 0 0 0 0 0 0 0 0 0 0 0 0
  18445. -1.6631 0.3891 1.8879 H 0 0 0 0 0 0 0 0 0 0 0 0
  18446. 2.3464 0.2253 0.9618 H 0 0 0 0 0 0 0 0 0 0 0 0
  18447. 1.8678 -0.2906 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  18448. 1 2 2 0
  18449. 2 3 1 0
  18450. 3 4 2 0
  18451. 4 5 1 0
  18452. 5 6 2 0
  18453. 6 1 1 0
  18454. 1 7 1 0
  18455. 2 8 1 0
  18456. 3 9 1 0
  18457. 5 10 1 0
  18458. 6 11 1 0
  18459. M END
  18460. $$$$
  18461. RDKit 3D
  18462. 11 11 0 0 0 0 0 0 0 0999 V2000
  18463. -0.2702 -0.2358 -1.1283 C 0 0 0 0 0 0 0 0 0 0 0 0
  18464. -1.2785 -0.0498 -0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0
  18465. -0.9129 0.2241 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0
  18466. 0.3682 0.3214 1.5375 N 0 0 0 0 0 0 0 0 0 0 0 0
  18467. 1.3253 0.1359 0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0
  18468. 1.0589 -0.1419 -0.7289 C 0 0 0 0 0 0 0 0 0 0 0 0
  18469. -0.5180 -0.4522 -2.1634 H 0 0 0 0 0 0 0 0 0 0 0 0
  18470. -2.3238 -0.1164 -0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0
  18471. -1.6631 0.3772 1.8903 H 0 0 0 0 0 0 0 0 0 0 0 0
  18472. 2.3464 0.2192 0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0
  18473. 1.8678 -0.2816 -1.4368 H 0 0 0 0 0 0 0 0 0 0 0 0
  18474. 1 2 2 0
  18475. 2 3 1 0
  18476. 3 4 2 0
  18477. 4 5 1 0
  18478. 5 6 2 0
  18479. 6 1 1 0
  18480. 1 7 1 0
  18481. 2 8 1 0
  18482. 3 9 1 0
  18483. 5 10 1 0
  18484. 6 11 1 0
  18485. M END
  18486. $$$$
  18487. RDKit 3D
  18488. 11 11 0 0 0 0 0 0 0 0999 V2000
  18489. -0.2702 -0.2287 -1.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  18490. -1.2785 -0.0486 -0.1887 C 0 0 0 0 0 0 0 0 0 0 0 0
  18491. -0.9129 0.2171 1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0
  18492. 0.3682 0.3117 1.5395 N 0 0 0 0 0 0 0 0 0 0 0 0
  18493. 1.3253 0.1321 0.6033 C 0 0 0 0 0 0 0 0 0 0 0 0
  18494. 1.0589 -0.1373 -0.7297 C 0 0 0 0 0 0 0 0 0 0 0 0
  18495. -0.5180 -0.4386 -2.1662 H 0 0 0 0 0 0 0 0 0 0 0 0
  18496. -2.3238 -0.1135 -0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0
  18497. -1.6631 0.3653 1.8926 H 0 0 0 0 0 0 0 0 0 0 0 0
  18498. 2.3464 0.2132 0.9645 H 0 0 0 0 0 0 0 0 0 0 0 0
  18499. 1.8678 -0.2726 -1.4386 H 0 0 0 0 0 0 0 0 0 0 0 0
  18500. 1 2 2 0
  18501. 2 3 1 0
  18502. 3 4 2 0
  18503. 4 5 1 0
  18504. 5 6 2 0
  18505. 6 1 1 0
  18506. 1 7 1 0
  18507. 2 8 1 0
  18508. 3 9 1 0
  18509. 5 10 1 0
  18510. 6 11 1 0
  18511. M END
  18512. $$$$
  18513. RDKit 3D
  18514. 11 11 0 0 0 0 0 0 0 0999 V2000
  18515. -0.2702 -0.2216 -1.1311 C 0 0 0 0 0 0 0 0 0 0 0 0
  18516. -1.2785 -0.0474 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0
  18517. -0.9129 0.2100 1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0
  18518. 0.3682 0.3020 1.5414 N 0 0 0 0 0 0 0 0 0 0 0 0
  18519. 1.3253 0.1283 0.6041 C 0 0 0 0 0 0 0 0 0 0 0 0
  18520. 1.0589 -0.1327 -0.7306 C 0 0 0 0 0 0 0 0 0 0 0 0
  18521. -0.5180 -0.4250 -2.1689 H 0 0 0 0 0 0 0 0 0 0 0 0
  18522. -2.3238 -0.1106 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  18523. -1.6631 0.3534 1.8949 H 0 0 0 0 0 0 0 0 0 0 0 0
  18524. 2.3464 0.2071 0.9658 H 0 0 0 0 0 0 0 0 0 0 0 0
  18525. 1.8678 -0.2635 -1.4403 H 0 0 0 0 0 0 0 0 0 0 0 0
  18526. 1 2 2 0
  18527. 2 3 1 0
  18528. 3 4 2 0
  18529. 4 5 1 0
  18530. 5 6 2 0
  18531. 6 1 1 0
  18532. 1 7 1 0
  18533. 2 8 1 0
  18534. 3 9 1 0
  18535. 5 10 1 0
  18536. 6 11 1 0
  18537. M END
  18538. $$$$
  18539. RDKit 3D
  18540. 11 11 0 0 0 0 0 0 0 0999 V2000
  18541. -0.2702 -0.2145 -1.1325 C 0 0 0 0 0 0 0 0 0 0 0 0
  18542. -1.2785 -0.0462 -0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0
  18543. -0.9129 0.2029 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0
  18544. 0.3682 0.2923 1.5433 N 0 0 0 0 0 0 0 0 0 0 0 0
  18545. 1.3253 0.1245 0.6049 C 0 0 0 0 0 0 0 0 0 0 0 0
  18546. 1.0589 -0.1281 -0.7314 C 0 0 0 0 0 0 0 0 0 0 0 0
  18547. -0.5180 -0.4113 -2.1715 H 0 0 0 0 0 0 0 0 0 0 0 0
  18548. -2.3238 -0.1076 -0.4697 H 0 0 0 0 0 0 0 0 0 0 0 0
  18549. -1.6631 0.3415 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  18550. 2.3464 0.2010 0.9671 H 0 0 0 0 0 0 0 0 0 0 0 0
  18551. 1.8678 -0.2545 -1.4419 H 0 0 0 0 0 0 0 0 0 0 0 0
  18552. 1 2 2 0
  18553. 2 3 1 0
  18554. 3 4 2 0
  18555. 4 5 1 0
  18556. 5 6 2 0
  18557. 6 1 1 0
  18558. 1 7 1 0
  18559. 2 8 1 0
  18560. 3 9 1 0
  18561. 5 10 1 0
  18562. 6 11 1 0
  18563. M END
  18564. $$$$
  18565. RDKit 3D
  18566. 11 11 0 0 0 0 0 0 0 0999 V2000
  18567. -0.2702 -0.2074 -1.1338 C 0 0 0 0 0 0 0 0 0 0 0 0
  18568. -1.2785 -0.0451 -0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0
  18569. -0.9129 0.1959 1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
  18570. 0.3682 0.2826 1.5451 N 0 0 0 0 0 0 0 0 0 0 0 0
  18571. 1.3253 0.1207 0.6056 C 0 0 0 0 0 0 0 0 0 0 0 0
  18572. 1.0589 -0.1236 -0.7322 C 0 0 0 0 0 0 0 0 0 0 0 0
  18573. -0.5180 -0.3977 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0
  18574. -2.3238 -0.1047 -0.4704 H 0 0 0 0 0 0 0 0 0 0 0 0
  18575. -1.6631 0.3296 1.8992 H 0 0 0 0 0 0 0 0 0 0 0 0
  18576. 2.3464 0.1949 0.9684 H 0 0 0 0 0 0 0 0 0 0 0 0
  18577. 1.8678 -0.2454 -1.4435 H 0 0 0 0 0 0 0 0 0 0 0 0
  18578. 1 2 2 0
  18579. 2 3 1 0
  18580. 3 4 2 0
  18581. 4 5 1 0
  18582. 5 6 2 0
  18583. 6 1 1 0
  18584. 1 7 1 0
  18585. 2 8 1 0
  18586. 3 9 1 0
  18587. 5 10 1 0
  18588. 6 11 1 0
  18589. M END
  18590. $$$$
  18591. RDKit 3D
  18592. 11 11 0 0 0 0 0 0 0 0999 V2000
  18593. -0.2702 -0.2003 -1.1351 C 0 0 0 0 0 0 0 0 0 0 0 0
  18594. -1.2785 -0.0439 -0.1899 C 0 0 0 0 0 0 0 0 0 0 0 0
  18595. -0.9129 0.1888 1.1264 C 0 0 0 0 0 0 0 0 0 0 0 0
  18596. 0.3682 0.2729 1.5468 N 0 0 0 0 0 0 0 0 0 0 0 0
  18597. 1.3253 0.1169 0.6064 C 0 0 0 0 0 0 0 0 0 0 0 0
  18598. 1.0589 -0.1189 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0
  18599. -0.5180 -0.3840 -2.1765 H 0 0 0 0 0 0 0 0 0 0 0 0
  18600. -2.3238 -0.1017 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
  18601. -1.6631 0.3176 1.9012 H 0 0 0 0 0 0 0 0 0 0 0 0
  18602. 2.3464 0.1888 0.9696 H 0 0 0 0 0 0 0 0 0 0 0 0
  18603. 1.8678 -0.2363 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  18604. 1 2 2 0
  18605. 2 3 1 0
  18606. 3 4 2 0
  18607. 4 5 1 0
  18608. 5 6 2 0
  18609. 6 1 1 0
  18610. 1 7 1 0
  18611. 2 8 1 0
  18612. 3 9 1 0
  18613. 5 10 1 0
  18614. 6 11 1 0
  18615. M END
  18616. $$$$
  18617. RDKit 3D
  18618. 11 11 0 0 0 0 0 0 0 0999 V2000
  18619. -0.2702 -0.1931 -1.1363 C 0 0 0 0 0 0 0 0 0 0 0 0
  18620. -1.2785 -0.0427 -0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0
  18621. -0.9129 0.1817 1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
  18622. 0.3682 0.2632 1.5485 N 0 0 0 0 0 0 0 0 0 0 0 0
  18623. 1.3253 0.1131 0.6071 C 0 0 0 0 0 0 0 0 0 0 0 0
  18624. 1.0589 -0.1143 -0.7337 C 0 0 0 0 0 0 0 0 0 0 0 0
  18625. -0.5180 -0.3703 -2.1789 H 0 0 0 0 0 0 0 0 0 0 0 0
  18626. -2.3238 -0.0987 -0.4717 H 0 0 0 0 0 0 0 0 0 0 0 0
  18627. -1.6631 0.3057 1.9031 H 0 0 0 0 0 0 0 0 0 0 0 0
  18628. 2.3464 0.1828 0.9707 H 0 0 0 0 0 0 0 0 0 0 0 0
  18629. 1.8678 -0.2273 -1.4464 H 0 0 0 0 0 0 0 0 0 0 0 0
  18630. 1 2 2 0
  18631. 2 3 1 0
  18632. 3 4 2 0
  18633. 4 5 1 0
  18634. 5 6 2 0
  18635. 6 1 1 0
  18636. 1 7 1 0
  18637. 2 8 1 0
  18638. 3 9 1 0
  18639. 5 10 1 0
  18640. 6 11 1 0
  18641. M END
  18642. $$$$
  18643. RDKit 3D
  18644. 11 11 0 0 0 0 0 0 0 0999 V2000
  18645. -0.2702 -0.1860 -1.1375 C 0 0 0 0 0 0 0 0 0 0 0 0
  18646. -1.2785 -0.0415 -0.1904 C 0 0 0 0 0 0 0 0 0 0 0 0
  18647. -0.9129 0.1746 1.1287 C 0 0 0 0 0 0 0 0 0 0 0 0
  18648. 0.3682 0.2535 1.5501 N 0 0 0 0 0 0 0 0 0 0 0 0
  18649. 1.3253 0.1093 0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0
  18650. 1.0589 -0.1097 -0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0
  18651. -0.5180 -0.3566 -2.1811 H 0 0 0 0 0 0 0 0 0 0 0 0
  18652. -2.3238 -0.0958 -0.4723 H 0 0 0 0 0 0 0 0 0 0 0 0
  18653. -1.6631 0.2937 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0
  18654. 2.3464 0.1766 0.9719 H 0 0 0 0 0 0 0 0 0 0 0 0
  18655. 1.8678 -0.2182 -1.4478 H 0 0 0 0 0 0 0 0 0 0 0 0
  18656. 1 2 2 0
  18657. 2 3 1 0
  18658. 3 4 2 0
  18659. 4 5 1 0
  18660. 5 6 2 0
  18661. 6 1 1 0
  18662. 1 7 1 0
  18663. 2 8 1 0
  18664. 3 9 1 0
  18665. 5 10 1 0
  18666. 6 11 1 0
  18667. M END
  18668. $$$$
  18669. RDKit 3D
  18670. 11 11 0 0 0 0 0 0 0 0999 V2000
  18671. -0.2702 -0.1788 -1.1387 C 0 0 0 0 0 0 0 0 0 0 0 0
  18672. -1.2785 -0.0403 -0.1906 C 0 0 0 0 0 0 0 0 0 0 0 0
  18673. -0.9129 0.1675 1.1298 C 0 0 0 0 0 0 0 0 0 0 0 0
  18674. 0.3682 0.2437 1.5517 N 0 0 0 0 0 0 0 0 0 0 0 0
  18675. 1.3253 0.1055 0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0
  18676. 1.0589 -0.1051 -0.7351 C 0 0 0 0 0 0 0 0 0 0 0 0
  18677. -0.5180 -0.3429 -2.1833 H 0 0 0 0 0 0 0 0 0 0 0 0
  18678. -2.3238 -0.0928 -0.4729 H 0 0 0 0 0 0 0 0 0 0 0 0
  18679. -1.6631 0.2817 1.9068 H 0 0 0 0 0 0 0 0 0 0 0 0
  18680. 2.3464 0.1705 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0
  18681. 1.8678 -0.2091 -1.4492 H 0 0 0 0 0 0 0 0 0 0 0 0
  18682. 1 2 2 0
  18683. 2 3 1 0
  18684. 3 4 2 0
  18685. 4 5 1 0
  18686. 5 6 2 0
  18687. 6 1 1 0
  18688. 1 7 1 0
  18689. 2 8 1 0
  18690. 3 9 1 0
  18691. 5 10 1 0
  18692. 6 11 1 0
  18693. M END
  18694. $$$$
  18695. RDKit 3D
  18696. 11 11 0 0 0 0 0 0 0 0999 V2000
  18697. -0.2702 -0.1717 -1.1398 C 0 0 0 0 0 0 0 0 0 0 0 0
  18698. -1.2785 -0.0391 -0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0
  18699. -0.9129 0.1604 1.1308 C 0 0 0 0 0 0 0 0 0 0 0 0
  18700. 0.3682 0.2340 1.5532 N 0 0 0 0 0 0 0 0 0 0 0 0
  18701. 1.3253 0.1016 0.6091 C 0 0 0 0 0 0 0 0 0 0 0 0
  18702. 1.0589 -0.1005 -0.7357 C 0 0 0 0 0 0 0 0 0 0 0 0
  18703. -0.5180 -0.3292 -2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0
  18704. -2.3238 -0.0898 -0.4735 H 0 0 0 0 0 0 0 0 0 0 0 0
  18705. -1.6631 0.2698 1.9086 H 0 0 0 0 0 0 0 0 0 0 0 0
  18706. 2.3464 0.1644 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0
  18707. 1.8678 -0.2000 -1.4504 H 0 0 0 0 0 0 0 0 0 0 0 0
  18708. 1 2 2 0
  18709. 2 3 1 0
  18710. 3 4 2 0
  18711. 4 5 1 0
  18712. 5 6 2 0
  18713. 6 1 1 0
  18714. 1 7 1 0
  18715. 2 8 1 0
  18716. 3 9 1 0
  18717. 5 10 1 0
  18718. 6 11 1 0
  18719. M END
  18720. $$$$
  18721. RDKit 3D
  18722. 11 11 0 0 0 0 0 0 0 0999 V2000
  18723. -0.2702 -0.1645 -1.1408 C 0 0 0 0 0 0 0 0 0 0 0 0
  18724. -1.2785 -0.0379 -0.1911 C 0 0 0 0 0 0 0 0 0 0 0 0
  18725. -0.9129 0.1533 1.1318 C 0 0 0 0 0 0 0 0 0 0 0 0
  18726. 0.3682 0.2242 1.5546 N 0 0 0 0 0 0 0 0 0 0 0 0
  18727. 1.3253 0.0978 0.6098 C 0 0 0 0 0 0 0 0 0 0 0 0
  18728. 1.0589 -0.0959 -0.7363 C 0 0 0 0 0 0 0 0 0 0 0 0
  18729. -0.5180 -0.3154 -2.1875 H 0 0 0 0 0 0 0 0 0 0 0 0
  18730. -2.3238 -0.0869 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0
  18731. -1.6631 0.2578 1.9102 H 0 0 0 0 0 0 0 0 0 0 0 0
  18732. 2.3464 0.1583 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0
  18733. 1.8678 -0.1908 -1.4517 H 0 0 0 0 0 0 0 0 0 0 0 0
  18734. 1 2 2 0
  18735. 2 3 1 0
  18736. 3 4 2 0
  18737. 4 5 1 0
  18738. 5 6 2 0
  18739. 6 1 1 0
  18740. 1 7 1 0
  18741. 2 8 1 0
  18742. 3 9 1 0
  18743. 5 10 1 0
  18744. 6 11 1 0
  18745. M END
  18746. $$$$
  18747. RDKit 3D
  18748. 11 11 0 0 0 0 0 0 0 0999 V2000
  18749. -0.2702 -0.1573 -1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  18750. -1.2785 -0.0367 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0
  18751. -0.9129 0.1462 1.1328 C 0 0 0 0 0 0 0 0 0 0 0 0
  18752. 0.3682 0.2144 1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0
  18753. 1.3253 0.0940 0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0
  18754. 1.0589 -0.0912 -0.7369 C 0 0 0 0 0 0 0 0 0 0 0 0
  18755. -0.5180 -0.3017 -2.1894 H 0 0 0 0 0 0 0 0 0 0 0 0
  18756. -2.3238 -0.0839 -0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0
  18757. -1.6631 0.2458 1.9118 H 0 0 0 0 0 0 0 0 0 0 0 0
  18758. 2.3464 0.1522 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
  18759. 1.8678 -0.1817 -1.4528 H 0 0 0 0 0 0 0 0 0 0 0 0
  18760. 1 2 2 0
  18761. 2 3 1 0
  18762. 3 4 2 0
  18763. 4 5 1 0
  18764. 5 6 2 0
  18765. 6 1 1 0
  18766. 1 7 1 0
  18767. 2 8 1 0
  18768. 3 9 1 0
  18769. 5 10 1 0
  18770. 6 11 1 0
  18771. M END
  18772. $$$$
  18773. RDKit 3D
  18774. 11 11 0 0 0 0 0 0 0 0999 V2000
  18775. -0.2702 -0.1502 -1.1428 C 0 0 0 0 0 0 0 0 0 0 0 0
  18776. -1.2785 -0.0355 -0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0
  18777. -0.9129 0.1391 1.1337 C 0 0 0 0 0 0 0 0 0 0 0 0
  18778. 0.3682 0.2046 1.5573 N 0 0 0 0 0 0 0 0 0 0 0 0
  18779. 1.3253 0.0901 0.6109 C 0 0 0 0 0 0 0 0 0 0 0 0
  18780. 1.0589 -0.0866 -0.7375 C 0 0 0 0 0 0 0 0 0 0 0 0
  18781. -0.5180 -0.2879 -2.1913 H 0 0 0 0 0 0 0 0 0 0 0 0
  18782. -2.3238 -0.0809 -0.4751 H 0 0 0 0 0 0 0 0 0 0 0 0
  18783. -1.6631 0.2337 1.9133 H 0 0 0 0 0 0 0 0 0 0 0 0
  18784. 2.3464 0.1460 0.9769 H 0 0 0 0 0 0 0 0 0 0 0 0
  18785. 1.8678 -0.1726 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
  18786. 1 2 2 0
  18787. 2 3 1 0
  18788. 3 4 2 0
  18789. 4 5 1 0
  18790. 5 6 2 0
  18791. 6 1 1 0
  18792. 1 7 1 0
  18793. 2 8 1 0
  18794. 3 9 1 0
  18795. 5 10 1 0
  18796. 6 11 1 0
  18797. M END
  18798. $$$$
  18799. RDKit 3D
  18800. 11 11 0 0 0 0 0 0 0 0999 V2000
  18801. -0.2702 -0.1430 -1.1437 C 0 0 0 0 0 0 0 0 0 0 0 0
  18802. -1.2785 -0.0343 -0.1918 C 0 0 0 0 0 0 0 0 0 0 0 0
  18803. -0.9129 0.1320 1.1345 C 0 0 0 0 0 0 0 0 0 0 0 0
  18804. 0.3682 0.1948 1.5586 N 0 0 0 0 0 0 0 0 0 0 0 0
  18805. 1.3253 0.0863 0.6115 C 0 0 0 0 0 0 0 0 0 0 0 0
  18806. 1.0589 -0.0820 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0
  18807. -0.5180 -0.2742 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0
  18808. -2.3238 -0.0779 -0.4756 H 0 0 0 0 0 0 0 0 0 0 0 0
  18809. -1.6631 0.2217 1.9147 H 0 0 0 0 0 0 0 0 0 0 0 0
  18810. 2.3464 0.1399 0.9778 H 0 0 0 0 0 0 0 0 0 0 0 0
  18811. 1.8678 -0.1634 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0
  18812. 1 2 2 0
  18813. 2 3 1 0
  18814. 3 4 2 0
  18815. 4 5 1 0
  18816. 5 6 2 0
  18817. 6 1 1 0
  18818. 1 7 1 0
  18819. 2 8 1 0
  18820. 3 9 1 0
  18821. 5 10 1 0
  18822. 6 11 1 0
  18823. M END
  18824. $$$$
  18825. RDKit 3D
  18826. 11 11 0 0 0 0 0 0 0 0999 V2000
  18827. -0.2702 -0.1358 -1.1446 C 0 0 0 0 0 0 0 0 0 0 0 0
  18828. -1.2785 -0.0331 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0
  18829. -0.9129 0.1248 1.1353 C 0 0 0 0 0 0 0 0 0 0 0 0
  18830. 0.3682 0.1850 1.5598 N 0 0 0 0 0 0 0 0 0 0 0 0
  18831. 1.3253 0.0825 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0
  18832. 1.0589 -0.0773 -0.7385 C 0 0 0 0 0 0 0 0 0 0 0 0
  18833. -0.5180 -0.2604 -2.1947 H 0 0 0 0 0 0 0 0 0 0 0 0
  18834. -2.3238 -0.0749 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  18835. -1.6631 0.2097 1.9161 H 0 0 0 0 0 0 0 0 0 0 0 0
  18836. 2.3464 0.1337 0.9787 H 0 0 0 0 0 0 0 0 0 0 0 0
  18837. 1.8678 -0.1543 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0
  18838. 1 2 2 0
  18839. 2 3 1 0
  18840. 3 4 2 0
  18841. 4 5 1 0
  18842. 5 6 2 0
  18843. 6 1 1 0
  18844. 1 7 1 0
  18845. 2 8 1 0
  18846. 3 9 1 0
  18847. 5 10 1 0
  18848. 6 11 1 0
  18849. M END
  18850. $$$$
  18851. RDKit 3D
  18852. 11 11 0 0 0 0 0 0 0 0999 V2000
  18853. -0.2702 -0.1286 -1.1454 C 0 0 0 0 0 0 0 0 0 0 0 0
  18854. -1.2785 -0.0319 -0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0
  18855. -0.9129 0.1177 1.1361 C 0 0 0 0 0 0 0 0 0 0 0 0
  18856. 0.3682 0.1752 1.5609 N 0 0 0 0 0 0 0 0 0 0 0 0
  18857. 1.3253 0.0786 0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0
  18858. 1.0589 -0.0727 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0
  18859. -0.5180 -0.2466 -2.1963 H 0 0 0 0 0 0 0 0 0 0 0 0
  18860. -2.3238 -0.0719 -0.4765 H 0 0 0 0 0 0 0 0 0 0 0 0
  18861. -1.6631 0.1976 1.9174 H 0 0 0 0 0 0 0 0 0 0 0 0
  18862. 2.3464 0.1276 0.9795 H 0 0 0 0 0 0 0 0 0 0 0 0
  18863. 1.8678 -0.1452 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  18864. 1 2 2 0
  18865. 2 3 1 0
  18866. 3 4 2 0
  18867. 4 5 1 0
  18868. 5 6 2 0
  18869. 6 1 1 0
  18870. 1 7 1 0
  18871. 2 8 1 0
  18872. 3 9 1 0
  18873. 5 10 1 0
  18874. 6 11 1 0
  18875. M END
  18876. $$$$
  18877. RDKit 3D
  18878. 11 11 0 0 0 0 0 0 0 0999 V2000
  18879. -0.2702 -0.1214 -1.1462 C 0 0 0 0 0 0 0 0 0 0 0 0
  18880. -1.2785 -0.0306 -0.1924 C 0 0 0 0 0 0 0 0 0 0 0 0
  18881. -0.9129 0.1106 1.1368 C 0 0 0 0 0 0 0 0 0 0 0 0
  18882. 0.3682 0.1654 1.5620 N 0 0 0 0 0 0 0 0 0 0 0 0
  18883. 1.3253 0.0748 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0
  18884. 1.0589 -0.0680 -0.7394 C 0 0 0 0 0 0 0 0 0 0 0 0
  18885. -0.5180 -0.2328 -2.1978 H 0 0 0 0 0 0 0 0 0 0 0 0
  18886. -2.3238 -0.0689 -0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
  18887. -1.6631 0.1856 1.9186 H 0 0 0 0 0 0 0 0 0 0 0 0
  18888. 2.3464 0.1214 0.9803 H 0 0 0 0 0 0 0 0 0 0 0 0
  18889. 1.8678 -0.1360 -1.4578 H 0 0 0 0 0 0 0 0 0 0 0 0
  18890. 1 2 2 0
  18891. 2 3 1 0
  18892. 3 4 2 0
  18893. 4 5 1 0
  18894. 5 6 2 0
  18895. 6 1 1 0
  18896. 1 7 1 0
  18897. 2 8 1 0
  18898. 3 9 1 0
  18899. 5 10 1 0
  18900. 6 11 1 0
  18901. M END
  18902. $$$$
  18903. RDKit 3D
  18904. 11 11 0 0 0 0 0 0 0 0999 V2000
  18905. -0.2702 -0.1142 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  18906. -1.2785 -0.0294 -0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0
  18907. -0.9129 0.1034 1.1375 C 0 0 0 0 0 0 0 0 0 0 0 0
  18908. 0.3682 0.1556 1.5630 N 0 0 0 0 0 0 0 0 0 0 0 0
  18909. 1.3253 0.0709 0.6135 C 0 0 0 0 0 0 0 0 0 0 0 0
  18910. 1.0589 -0.0634 -0.7398 C 0 0 0 0 0 0 0 0 0 0 0 0
  18911. -0.5180 -0.2190 -2.1992 H 0 0 0 0 0 0 0 0 0 0 0 0
  18912. -2.3238 -0.0659 -0.4774 H 0 0 0 0 0 0 0 0 0 0 0 0
  18913. -1.6631 0.1735 1.9197 H 0 0 0 0 0 0 0 0 0 0 0 0
  18914. 2.3464 0.1153 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0
  18915. 1.8678 -0.1268 -1.4587 H 0 0 0 0 0 0 0 0 0 0 0 0
  18916. 1 2 2 0
  18917. 2 3 1 0
  18918. 3 4 2 0
  18919. 4 5 1 0
  18920. 5 6 2 0
  18921. 6 1 1 0
  18922. 1 7 1 0
  18923. 2 8 1 0
  18924. 3 9 1 0
  18925. 5 10 1 0
  18926. 6 11 1 0
  18927. M END
  18928. $$$$
  18929. RDKit 3D
  18930. 11 11 0 0 0 0 0 0 0 0999 V2000
  18931. -0.2702 -0.1070 -1.1477 C 0 0 0 0 0 0 0 0 0 0 0 0
  18932. -1.2785 -0.0282 -0.1928 C 0 0 0 0 0 0 0 0 0 0 0 0
  18933. -0.9129 0.0963 1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0
  18934. 0.3682 0.1458 1.5639 N 0 0 0 0 0 0 0 0 0 0 0 0
  18935. 1.3253 0.0670 0.6139 C 0 0 0 0 0 0 0 0 0 0 0 0
  18936. 1.0589 -0.0587 -0.7402 C 0 0 0 0 0 0 0 0 0 0 0 0
  18937. -0.5180 -0.2051 -2.2006 H 0 0 0 0 0 0 0 0 0 0 0 0
  18938. -2.3238 -0.0629 -0.4778 H 0 0 0 0 0 0 0 0 0 0 0 0
  18939. -1.6631 0.1615 1.9208 H 0 0 0 0 0 0 0 0 0 0 0 0
  18940. 2.3464 0.1091 0.9817 H 0 0 0 0 0 0 0 0 0 0 0 0
  18941. 1.8678 -0.1177 -1.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
  18942. 1 2 2 0
  18943. 2 3 1 0
  18944. 3 4 2 0
  18945. 4 5 1 0
  18946. 5 6 2 0
  18947. 6 1 1 0
  18948. 1 7 1 0
  18949. 2 8 1 0
  18950. 3 9 1 0
  18951. 5 10 1 0
  18952. 6 11 1 0
  18953. M END
  18954. $$$$
  18955. RDKit 3D
  18956. 11 11 0 0 0 0 0 0 0 0999 V2000
  18957. -0.2702 -0.0998 -1.1483 C 0 0 0 0 0 0 0 0 0 0 0 0
  18958. -1.2785 -0.0270 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0
  18959. -0.9129 0.0891 1.1387 C 0 0 0 0 0 0 0 0 0 0 0 0
  18960. 0.3682 0.1360 1.5648 N 0 0 0 0 0 0 0 0 0 0 0 0
  18961. 1.3253 0.0632 0.6143 C 0 0 0 0 0 0 0 0 0 0 0 0
  18962. 1.0589 -0.0541 -0.7406 C 0 0 0 0 0 0 0 0 0 0 0 0
  18963. -0.5180 -0.1913 -2.2018 H 0 0 0 0 0 0 0 0 0 0 0 0
  18964. -2.3238 -0.0599 -0.4782 H 0 0 0 0 0 0 0 0 0 0 0 0
  18965. -1.6631 0.1494 1.9217 H 0 0 0 0 0 0 0 0 0 0 0 0
  18966. 2.3464 0.1029 0.9824 H 0 0 0 0 0 0 0 0 0 0 0 0
  18967. 1.8678 -0.1085 -1.4601 H 0 0 0 0 0 0 0 0 0 0 0 0
  18968. 1 2 2 0
  18969. 2 3 1 0
  18970. 3 4 2 0
  18971. 4 5 1 0
  18972. 5 6 2 0
  18973. 6 1 1 0
  18974. 1 7 1 0
  18975. 2 8 1 0
  18976. 3 9 1 0
  18977. 5 10 1 0
  18978. 6 11 1 0
  18979. M END
  18980. $$$$
  18981. RDKit 3D
  18982. 11 11 0 0 0 0 0 0 0 0999 V2000
  18983. -0.2702 -0.0926 -1.1489 C 0 0 0 0 0 0 0 0 0 0 0 0
  18984. -1.2785 -0.0258 -0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0
  18985. -0.9129 0.0820 1.1392 C 0 0 0 0 0 0 0 0 0 0 0 0
  18986. 0.3682 0.1261 1.5657 N 0 0 0 0 0 0 0 0 0 0 0 0
  18987. 1.3253 0.0593 0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0
  18988. 1.0589 -0.0494 -0.7409 C 0 0 0 0 0 0 0 0 0 0 0 0
  18989. -0.5180 -0.1775 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0
  18990. -2.3238 -0.0569 -0.4785 H 0 0 0 0 0 0 0 0 0 0 0 0
  18991. -1.6631 0.1373 1.9226 H 0 0 0 0 0 0 0 0 0 0 0 0
  18992. 2.3464 0.0968 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0
  18993. 1.8678 -0.0993 -1.4608 H 0 0 0 0 0 0 0 0 0 0 0 0
  18994. 1 2 2 0
  18995. 2 3 1 0
  18996. 3 4 2 0
  18997. 4 5 1 0
  18998. 5 6 2 0
  18999. 6 1 1 0
  19000. 1 7 1 0
  19001. 2 8 1 0
  19002. 3 9 1 0
  19003. 5 10 1 0
  19004. 6 11 1 0
  19005. M END
  19006. $$$$
  19007. RDKit 3D
  19008. 11 11 0 0 0 0 0 0 0 0999 V2000
  19009. -0.2702 -0.0853 -1.1495 C 0 0 0 0 0 0 0 0 0 0 0 0
  19010. -1.2785 -0.0246 -0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0
  19011. -0.9129 0.0748 1.1397 C 0 0 0 0 0 0 0 0 0 0 0 0
  19012. 0.3682 0.1163 1.5664 N 0 0 0 0 0 0 0 0 0 0 0 0
  19013. 1.3253 0.0555 0.6151 C 0 0 0 0 0 0 0 0 0 0 0 0
  19014. 1.0589 -0.0448 -0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0
  19015. -0.5180 -0.1636 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
  19016. -2.3238 -0.0539 -0.4789 H 0 0 0 0 0 0 0 0 0 0 0 0
  19017. -1.6631 0.1252 1.9235 H 0 0 0 0 0 0 0 0 0 0 0 0
  19018. 2.3464 0.0906 0.9836 H 0 0 0 0 0 0 0 0 0 0 0 0
  19019. 1.8678 -0.0901 -1.4614 H 0 0 0 0 0 0 0 0 0 0 0 0
  19020. 1 2 2 0
  19021. 2 3 1 0
  19022. 3 4 2 0
  19023. 4 5 1 0
  19024. 5 6 2 0
  19025. 6 1 1 0
  19026. 1 7 1 0
  19027. 2 8 1 0
  19028. 3 9 1 0
  19029. 5 10 1 0
  19030. 6 11 1 0
  19031. M END
  19032. $$$$
  19033. RDKit 3D
  19034. 11 11 0 0 0 0 0 0 0 0999 V2000
  19035. -0.2702 -0.0781 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
  19036. -1.2785 -0.0234 -0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0
  19037. -0.9129 0.0676 1.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
  19038. 0.3682 0.1064 1.5671 N 0 0 0 0 0 0 0 0 0 0 0 0
  19039. 1.3253 0.0516 0.6154 C 0 0 0 0 0 0 0 0 0 0 0 0
  19040. 1.0589 -0.0401 -0.7415 C 0 0 0 0 0 0 0 0 0 0 0 0
  19041. -0.5180 -0.1498 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  19042. -2.3238 -0.0509 -0.4792 H 0 0 0 0 0 0 0 0 0 0 0 0
  19043. -1.6631 0.1131 1.9242 H 0 0 0 0 0 0 0 0 0 0 0 0
  19044. 2.3464 0.0844 0.9842 H 0 0 0 0 0 0 0 0 0 0 0 0
  19045. 1.8678 -0.0810 -1.4619 H 0 0 0 0 0 0 0 0 0 0 0 0
  19046. 1 2 2 0
  19047. 2 3 1 0
  19048. 3 4 2 0
  19049. 4 5 1 0
  19050. 5 6 2 0
  19051. 6 1 1 0
  19052. 1 7 1 0
  19053. 2 8 1 0
  19054. 3 9 1 0
  19055. 5 10 1 0
  19056. 6 11 1 0
  19057. M END
  19058. $$$$
  19059. RDKit 3D
  19060. 11 11 0 0 0 0 0 0 0 0999 V2000
  19061. -0.2702 -0.0709 -1.1505 C 0 0 0 0 0 0 0 0 0 0 0 0
  19062. -1.2785 -0.0222 -0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0
  19063. -0.9129 0.0605 1.1406 C 0 0 0 0 0 0 0 0 0 0 0 0
  19064. 0.3682 0.0966 1.5678 N 0 0 0 0 0 0 0 0 0 0 0 0
  19065. 1.3253 0.0477 0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0
  19066. 1.0589 -0.0355 -0.7417 C 0 0 0 0 0 0 0 0 0 0 0 0
  19067. -0.5180 -0.1359 -2.2059 H 0 0 0 0 0 0 0 0 0 0 0 0
  19068. -2.3238 -0.0479 -0.4795 H 0 0 0 0 0 0 0 0 0 0 0 0
  19069. -1.6631 0.1010 1.9249 H 0 0 0 0 0 0 0 0 0 0 0 0
  19070. 2.3464 0.0782 0.9847 H 0 0 0 0 0 0 0 0 0 0 0 0
  19071. 1.8678 -0.0718 -1.4624 H 0 0 0 0 0 0 0 0 0 0 0 0
  19072. 1 2 2 0
  19073. 2 3 1 0
  19074. 3 4 2 0
  19075. 4 5 1 0
  19076. 5 6 2 0
  19077. 6 1 1 0
  19078. 1 7 1 0
  19079. 2 8 1 0
  19080. 3 9 1 0
  19081. 5 10 1 0
  19082. 6 11 1 0
  19083. M END
  19084. $$$$
  19085. RDKit 3D
  19086. 11 11 0 0 0 0 0 0 0 0999 V2000
  19087. -0.2702 -0.0637 -1.1509 C 0 0 0 0 0 0 0 0 0 0 0 0
  19088. -1.2785 -0.0209 -0.1937 C 0 0 0 0 0 0 0 0 0 0 0 0
  19089. -0.9129 0.0533 1.1409 C 0 0 0 0 0 0 0 0 0 0 0 0
  19090. 0.3682 0.0867 1.5683 N 0 0 0 0 0 0 0 0 0 0 0 0
  19091. 1.3253 0.0439 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0
  19092. 1.0589 -0.0308 -0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0
  19093. -0.5180 -0.1221 -2.2067 H 0 0 0 0 0 0 0 0 0 0 0 0
  19094. -2.3238 -0.0449 -0.4798 H 0 0 0 0 0 0 0 0 0 0 0 0
  19095. -1.6631 0.0890 1.9255 H 0 0 0 0 0 0 0 0 0 0 0 0
  19096. 2.3464 0.0720 0.9852 H 0 0 0 0 0 0 0 0 0 0 0 0
  19097. 1.8678 -0.0626 -1.4628 H 0 0 0 0 0 0 0 0 0 0 0 0
  19098. 1 2 2 0
  19099. 2 3 1 0
  19100. 3 4 2 0
  19101. 4 5 1 0
  19102. 5 6 2 0
  19103. 6 1 1 0
  19104. 1 7 1 0
  19105. 2 8 1 0
  19106. 3 9 1 0
  19107. 5 10 1 0
  19108. 6 11 1 0
  19109. M END
  19110. $$$$
  19111. RDKit 3D
  19112. 11 11 0 0 0 0 0 0 0 0999 V2000
  19113. -0.2702 -0.0564 -1.1513 C 0 0 0 0 0 0 0 0 0 0 0 0
  19114. -1.2785 -0.0197 -0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0
  19115. -0.9129 0.0461 1.1412 C 0 0 0 0 0 0 0 0 0 0 0 0
  19116. 0.3682 0.0769 1.5688 N 0 0 0 0 0 0 0 0 0 0 0 0
  19117. 1.3253 0.0400 0.6163 C 0 0 0 0 0 0 0 0 0 0 0 0
  19118. 1.0589 -0.0261 -0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0
  19119. -0.5180 -0.1082 -2.2075 H 0 0 0 0 0 0 0 0 0 0 0 0
  19120. -2.3238 -0.0419 -0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0
  19121. -1.6631 0.0769 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
  19122. 2.3464 0.0658 0.9856 H 0 0 0 0 0 0 0 0 0 0 0 0
  19123. 1.8678 -0.0534 -1.4632 H 0 0 0 0 0 0 0 0 0 0 0 0
  19124. 1 2 2 0
  19125. 2 3 1 0
  19126. 3 4 2 0
  19127. 4 5 1 0
  19128. 5 6 2 0
  19129. 6 1 1 0
  19130. 1 7 1 0
  19131. 2 8 1 0
  19132. 3 9 1 0
  19133. 5 10 1 0
  19134. 6 11 1 0
  19135. M END
  19136. $$$$
  19137. RDKit 3D
  19138. 11 11 0 0 0 0 0 0 0 0999 V2000
  19139. -0.2702 -0.0492 -1.1516 C 0 0 0 0 0 0 0 0 0 0 0 0
  19140. -1.2785 -0.0185 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0
  19141. -0.9129 0.0390 1.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
  19142. 0.3682 0.0670 1.5693 N 0 0 0 0 0 0 0 0 0 0 0 0
  19143. 1.3253 0.0361 0.6165 C 0 0 0 0 0 0 0 0 0 0 0 0
  19144. 1.0589 -0.0215 -0.7422 C 0 0 0 0 0 0 0 0 0 0 0 0
  19145. -0.5180 -0.0943 -2.2081 H 0 0 0 0 0 0 0 0 0 0 0 0
  19146. -2.3238 -0.0388 -0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
  19147. -1.6631 0.0647 1.9264 H 0 0 0 0 0 0 0 0 0 0 0 0
  19148. 2.3464 0.0596 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0
  19149. 1.8678 -0.0442 -1.4635 H 0 0 0 0 0 0 0 0 0 0 0 0
  19150. 1 2 2 0
  19151. 2 3 1 0
  19152. 3 4 2 0
  19153. 4 5 1 0
  19154. 5 6 2 0
  19155. 6 1 1 0
  19156. 1 7 1 0
  19157. 2 8 1 0
  19158. 3 9 1 0
  19159. 5 10 1 0
  19160. 6 11 1 0
  19161. M END
  19162. $$$$
  19163. RDKit 3D
  19164. 11 11 0 0 0 0 0 0 0 0999 V2000
  19165. -0.2702 -0.0419 -1.1519 C 0 0 0 0 0 0 0 0 0 0 0 0
  19166. -1.2785 -0.0173 -0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
  19167. -0.9129 0.0318 1.1417 C 0 0 0 0 0 0 0 0 0 0 0 0
  19168. 0.3682 0.0572 1.5697 N 0 0 0 0 0 0 0 0 0 0 0 0
  19169. 1.3253 0.0322 0.6167 C 0 0 0 0 0 0 0 0 0 0 0 0
  19170. 1.0589 -0.0168 -0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0
  19171. -0.5180 -0.0804 -2.2086 H 0 0 0 0 0 0 0 0 0 0 0 0
  19172. -2.3238 -0.0358 -0.4806 H 0 0 0 0 0 0 0 0 0 0 0 0
  19173. -1.6631 0.0526 1.9268 H 0 0 0 0 0 0 0 0 0 0 0 0
  19174. 2.3464 0.0535 0.9863 H 0 0 0 0 0 0 0 0 0 0 0 0
  19175. 1.8678 -0.0350 -1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  19176. 1 2 2 0
  19177. 2 3 1 0
  19178. 3 4 2 0
  19179. 4 5 1 0
  19180. 5 6 2 0
  19181. 6 1 1 0
  19182. 1 7 1 0
  19183. 2 8 1 0
  19184. 3 9 1 0
  19185. 5 10 1 0
  19186. 6 11 1 0
  19187. M END
  19188. $$$$
  19189. RDKit 3D
  19190. 11 11 0 0 0 0 0 0 0 0999 V2000
  19191. -0.2702 -0.0347 -1.1521 C 0 0 0 0 0 0 0 0 0 0 0 0
  19192. -1.2785 -0.0161 -0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0
  19193. -0.9129 0.0246 1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  19194. 0.3682 0.0473 1.5700 N 0 0 0 0 0 0 0 0 0 0 0 0
  19195. 1.3253 0.0284 0.6169 C 0 0 0 0 0 0 0 0 0 0 0 0
  19196. 1.0589 -0.0122 -0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0
  19197. -0.5180 -0.0666 -2.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
  19198. -2.3238 -0.0328 -0.4808 H 0 0 0 0 0 0 0 0 0 0 0 0
  19199. -1.6631 0.0405 1.9271 H 0 0 0 0 0 0 0 0 0 0 0 0
  19200. 2.3464 0.0473 0.9867 H 0 0 0 0 0 0 0 0 0 0 0 0
  19201. 1.8678 -0.0258 -1.4639 H 0 0 0 0 0 0 0 0 0 0 0 0
  19202. 1 2 2 0
  19203. 2 3 1 0
  19204. 3 4 2 0
  19205. 4 5 1 0
  19206. 5 6 2 0
  19207. 6 1 1 0
  19208. 1 7 1 0
  19209. 2 8 1 0
  19210. 3 9 1 0
  19211. 5 10 1 0
  19212. 6 11 1 0
  19213. M END
  19214. $$$$
  19215. RDKit 3D
  19216. 11 11 0 0 0 0 0 0 0 0999 V2000
  19217. -0.2702 -0.0275 -1.1523 C 0 0 0 0 0 0 0 0 0 0 0 0
  19218. -1.2785 -0.0148 -0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0
  19219. -0.9129 0.0174 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0
  19220. 0.3682 0.0374 1.5703 N 0 0 0 0 0 0 0 0 0 0 0 0
  19221. 1.3253 0.0245 0.6171 C 0 0 0 0 0 0 0 0 0 0 0 0
  19222. 1.0589 -0.0075 -0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  19223. -0.5180 -0.0527 -2.2095 H 0 0 0 0 0 0 0 0 0 0 0 0
  19224. -2.3238 -0.0298 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0
  19225. -1.6631 0.0284 1.9273 H 0 0 0 0 0 0 0 0 0 0 0 0
  19226. 2.3464 0.0411 0.9869 H 0 0 0 0 0 0 0 0 0 0 0 0
  19227. 1.8678 -0.0166 -1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
  19228. 1 2 2 0
  19229. 2 3 1 0
  19230. 3 4 2 0
  19231. 4 5 1 0
  19232. 5 6 2 0
  19233. 6 1 1 0
  19234. 1 7 1 0
  19235. 2 8 1 0
  19236. 3 9 1 0
  19237. 5 10 1 0
  19238. 6 11 1 0
  19239. M END
  19240. $$$$
  19241. RDKit 3D
  19242. 11 11 0 0 0 0 0 0 0 0999 V2000
  19243. -0.2702 -0.0202 -1.1525 C 0 0 0 0 0 0 0 0 0 0 0 0
  19244. -1.2785 -0.0136 -0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0
  19245. -0.9129 0.0103 1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  19246. 0.3682 0.0276 1.5705 N 0 0 0 0 0 0 0 0 0 0 0 0
  19247. 1.3253 0.0206 0.6172 C 0 0 0 0 0 0 0 0 0 0 0 0
  19248. 1.0589 -0.0028 -0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  19249. -0.5180 -0.0388 -2.2098 H 0 0 0 0 0 0 0 0 0 0 0 0
  19250. -2.3238 -0.0268 -0.4812 H 0 0 0 0 0 0 0 0 0 0 0 0
  19251. -1.6631 0.0163 1.9275 H 0 0 0 0 0 0 0 0 0 0 0 0
  19252. 2.3464 0.0348 0.9872 H 0 0 0 0 0 0 0 0 0 0 0 0
  19253. 1.8678 -0.0074 -1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
  19254. 1 2 2 0
  19255. 2 3 1 0
  19256. 3 4 2 0
  19257. 4 5 1 0
  19258. 5 6 2 0
  19259. 6 1 1 0
  19260. 1 7 1 0
  19261. 2 8 1 0
  19262. 3 9 1 0
  19263. 5 10 1 0
  19264. 6 11 1 0
  19265. M END
  19266. $$$$
  19267. RDKit 3D
  19268. 11 11 0 0 0 0 0 0 0 0999 V2000
  19269. -0.2702 -0.0130 -1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  19270. -1.2785 -0.0124 -0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
  19271. -0.9129 0.0031 1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  19272. 0.3682 0.0177 1.5706 N 0 0 0 0 0 0 0 0 0 0 0 0
  19273. 1.3253 0.0167 0.6173 C 0 0 0 0 0 0 0 0 0 0 0 0
  19274. 1.0589 0.0018 -0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  19275. -0.5180 -0.0249 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  19276. -2.3238 -0.0237 -0.4813 H 0 0 0 0 0 0 0 0 0 0 0 0
  19277. -1.6631 0.0042 1.9275 H 0 0 0 0 0 0 0 0 0 0 0 0
  19278. 2.3464 0.0286 0.9874 H 0 0 0 0 0 0 0 0 0 0 0 0
  19279. 1.8678 0.0018 -1.4642 H 0 0 0 0 0 0 0 0 0 0 0 0
  19280. 1 2 2 0
  19281. 2 3 1 0
  19282. 3 4 2 0
  19283. 4 5 1 0
  19284. 5 6 2 0
  19285. 6 1 1 0
  19286. 1 7 1 0
  19287. 2 8 1 0
  19288. 3 9 1 0
  19289. 5 10 1 0
  19290. 6 11 1 0
  19291. M END
  19292. $$$$
  19293. RDKit 3D
  19294. 11 11 0 0 0 0 0 0 0 0999 V2000
  19295. -0.2702 -0.0057 -1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  19296. -1.2785 -0.0112 -0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
  19297. -0.9129 -0.0041 1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  19298. 0.3682 0.0078 1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
  19299. 1.3253 0.0129 0.6174 C 0 0 0 0 0 0 0 0 0 0 0 0
  19300. 1.0589 0.0065 -0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  19301. -0.5180 -0.0110 -2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0
  19302. -2.3238 -0.0207 -0.4815 H 0 0 0 0 0 0 0 0 0 0 0 0
  19303. -1.6631 -0.0079 1.9275 H 0 0 0 0 0 0 0 0 0 0 0 0
  19304. 2.3464 0.0224 0.9875 H 0 0 0 0 0 0 0 0 0 0 0 0
  19305. 1.8678 0.0110 -1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
  19306. 1 2 2 0
  19307. 2 3 1 0
  19308. 3 4 2 0
  19309. 4 5 1 0
  19310. 5 6 2 0
  19311. 6 1 1 0
  19312. 1 7 1 0
  19313. 2 8 1 0
  19314. 3 9 1 0
  19315. 5 10 1 0
  19316. 6 11 1 0
  19317. M END
  19318. $$$$
  19319. RDKit 3D
  19320. 11 11 0 0 0 0 0 0 0 0999 V2000
  19321. -0.2702 0.0015 -1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  19322. -1.2785 -0.0100 -0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
  19323. -0.9129 -0.0113 1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
  19324. 0.3682 -0.0020 1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
  19325. 1.3253 0.0090 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  19326. 1.0589 0.0112 -0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0
  19327. -0.5180 0.0029 -2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0
  19328. -2.3238 -0.0177 -0.4816 H 0 0 0 0 0 0 0 0 0 0 0 0
  19329. -1.6631 -0.0200 1.9274 H 0 0 0 0 0 0 0 0 0 0 0 0
  19330. 2.3464 0.0162 0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  19331. 1.8678 0.0202 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0
  19332. 1 2 2 0
  19333. 2 3 1 0
  19334. 3 4 2 0
  19335. 4 5 1 0
  19336. 5 6 2 0
  19337. 6 1 1 0
  19338. 1 7 1 0
  19339. 2 8 1 0
  19340. 3 9 1 0
  19341. 5 10 1 0
  19342. 6 11 1 0
  19343. M END
  19344. $$$$
  19345. RDKit 3D
  19346. 11 11 0 0 0 0 0 0 0 0999 V2000
  19347. -0.2702 0.0087 -1.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  19348. -1.2785 -0.0087 -0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  19349. -0.9129 -0.0184 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0
  19350. 0.3682 -0.0119 1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
  19351. 1.3253 0.0051 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  19352. 1.0589 0.0158 -0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0
  19353. -0.5180 0.0167 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  19354. -2.3238 -0.0147 -0.4817 H 0 0 0 0 0 0 0 0 0 0 0 0
  19355. -1.6631 -0.0321 1.9273 H 0 0 0 0 0 0 0 0 0 0 0 0
  19356. 2.3464 0.0100 0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  19357. 1.8678 0.0294 -1.4639 H 0 0 0 0 0 0 0 0 0 0 0 0
  19358. 1 2 2 0
  19359. 2 3 1 0
  19360. 3 4 2 0
  19361. 4 5 1 0
  19362. 5 6 2 0
  19363. 6 1 1 0
  19364. 1 7 1 0
  19365. 2 8 1 0
  19366. 3 9 1 0
  19367. 5 10 1 0
  19368. 6 11 1 0
  19369. M END
  19370. $$$$
  19371. RDKit 3D
  19372. 11 11 0 0 0 0 0 0 0 0999 V2000
  19373. -0.2702 0.0160 -1.1525 C 0 0 0 0 0 0 0 0 0 0 0 0
  19374. -1.2785 -0.0075 -0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  19375. -0.9129 -0.0256 1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  19376. 0.3682 -0.0218 1.5706 N 0 0 0 0 0 0 0 0 0 0 0 0
  19377. 1.3253 0.0012 0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0
  19378. 1.0589 0.0205 -0.7423 C 0 0 0 0 0 0 0 0 0 0 0 0
  19379. -0.5180 0.0306 -2.2099 H 0 0 0 0 0 0 0 0 0 0 0 0
  19380. -2.3238 -0.0116 -0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
  19381. -1.6631 -0.0442 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0
  19382. 2.3464 0.0038 0.9878 H 0 0 0 0 0 0 0 0 0 0 0 0
  19383. 1.8678 0.0386 -1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
  19384. 1 2 2 0
  19385. 2 3 1 0
  19386. 3 4 2 0
  19387. 4 5 1 0
  19388. 5 6 2 0
  19389. 6 1 1 0
  19390. 1 7 1 0
  19391. 2 8 1 0
  19392. 3 9 1 0
  19393. 5 10 1 0
  19394. 6 11 1 0
  19395. M END
  19396. $$$$
  19397. RDKit 3D
  19398. 11 11 0 0 0 0 0 0 0 0999 V2000
  19399. -0.2702 0.0232 -1.1524 C 0 0 0 0 0 0 0 0 0 0 0 0
  19400. -1.2785 -0.0063 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19401. -0.9129 -0.0328 1.1417 C 0 0 0 0 0 0 0 0 0 0 0 0
  19402. 0.3682 -0.0316 1.5704 N 0 0 0 0 0 0 0 0 0 0 0 0
  19403. 1.3253 -0.0027 0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0
  19404. 1.0589 0.0252 -0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0
  19405. -0.5180 0.0445 -2.2097 H 0 0 0 0 0 0 0 0 0 0 0 0
  19406. -2.3238 -0.0086 -0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
  19407. -1.6631 -0.0563 1.9267 H 0 0 0 0 0 0 0 0 0 0 0 0
  19408. 2.3464 -0.0024 0.9878 H 0 0 0 0 0 0 0 0 0 0 0 0
  19409. 1.8678 0.0478 -1.4634 H 0 0 0 0 0 0 0 0 0 0 0 0
  19410. 1 2 2 0
  19411. 2 3 1 0
  19412. 3 4 2 0
  19413. 4 5 1 0
  19414. 5 6 2 0
  19415. 6 1 1 0
  19416. 1 7 1 0
  19417. 2 8 1 0
  19418. 3 9 1 0
  19419. 5 10 1 0
  19420. 6 11 1 0
  19421. M END
  19422. $$$$
  19423. RDKit 3D
  19424. 11 11 0 0 0 0 0 0 0 0999 V2000
  19425. -0.2702 0.0305 -1.1522 C 0 0 0 0 0 0 0 0 0 0 0 0
  19426. -1.2785 -0.0051 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19427. -0.9129 -0.0400 1.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
  19428. 0.3682 -0.0415 1.5702 N 0 0 0 0 0 0 0 0 0 0 0 0
  19429. 1.3253 -0.0065 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  19430. 1.0589 0.0298 -0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0
  19431. -0.5180 0.0584 -2.2093 H 0 0 0 0 0 0 0 0 0 0 0 0
  19432. -2.3238 -0.0056 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  19433. -1.6631 -0.0684 1.9263 H 0 0 0 0 0 0 0 0 0 0 0 0
  19434. 2.3464 -0.0086 0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  19435. 1.8678 0.0570 -1.4631 H 0 0 0 0 0 0 0 0 0 0 0 0
  19436. 1 2 2 0
  19437. 2 3 1 0
  19438. 3 4 2 0
  19439. 4 5 1 0
  19440. 5 6 2 0
  19441. 6 1 1 0
  19442. 1 7 1 0
  19443. 2 8 1 0
  19444. 3 9 1 0
  19445. 5 10 1 0
  19446. 6 11 1 0
  19447. M END
  19448. $$$$
  19449. RDKit 3D
  19450. 11 11 0 0 0 0 0 0 0 0999 V2000
  19451. -0.2702 0.0377 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
  19452. -1.2785 -0.0038 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19453. -0.9129 -0.0471 1.1412 C 0 0 0 0 0 0 0 0 0 0 0 0
  19454. 0.3682 -0.0514 1.5699 N 0 0 0 0 0 0 0 0 0 0 0 0
  19455. 1.3253 -0.0104 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0
  19456. 1.0589 0.0345 -0.7417 C 0 0 0 0 0 0 0 0 0 0 0 0
  19457. -0.5180 0.0723 -2.2089 H 0 0 0 0 0 0 0 0 0 0 0 0
  19458. -2.3238 -0.0025 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  19459. -1.6631 -0.0805 1.9259 H 0 0 0 0 0 0 0 0 0 0 0 0
  19460. 2.3464 -0.0148 0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0
  19461. 1.8678 0.0662 -1.4627 H 0 0 0 0 0 0 0 0 0 0 0 0
  19462. 1 2 2 0
  19463. 2 3 1 0
  19464. 3 4 2 0
  19465. 4 5 1 0
  19466. 5 6 2 0
  19467. 6 1 1 0
  19468. 1 7 1 0
  19469. 2 8 1 0
  19470. 3 9 1 0
  19471. 5 10 1 0
  19472. 6 11 1 0
  19473. M END
  19474. $$$$
  19475. RDKit 3D
  19476. 11 11 0 0 0 0 0 0 0 0999 V2000
  19477. -0.2702 0.0449 -1.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
  19478. -1.2785 -0.0026 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19479. -0.9129 -0.0543 1.1409 C 0 0 0 0 0 0 0 0 0 0 0 0
  19480. 0.3682 -0.0612 1.5695 N 0 0 0 0 0 0 0 0 0 0 0 0
  19481. 1.3253 -0.0143 0.6174 C 0 0 0 0 0 0 0 0 0 0 0 0
  19482. 1.0589 0.0391 -0.7415 C 0 0 0 0 0 0 0 0 0 0 0 0
  19483. -0.5180 0.0862 -2.2084 H 0 0 0 0 0 0 0 0 0 0 0 0
  19484. -2.3238 0.0005 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  19485. -1.6631 -0.0926 1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0
  19486. 2.3464 -0.0210 0.9876 H 0 0 0 0 0 0 0 0 0 0 0 0
  19487. 1.8678 0.0754 -1.4622 H 0 0 0 0 0 0 0 0 0 0 0 0
  19488. 1 2 2 0
  19489. 2 3 1 0
  19490. 3 4 2 0
  19491. 4 5 1 0
  19492. 5 6 2 0
  19493. 6 1 1 0
  19494. 1 7 1 0
  19495. 2 8 1 0
  19496. 3 9 1 0
  19497. 5 10 1 0
  19498. 6 11 1 0
  19499. M END
  19500. $$$$
  19501. RDKit 3D
  19502. 11 11 0 0 0 0 0 0 0 0999 V2000
  19503. -0.2702 0.0522 -1.1515 C 0 0 0 0 0 0 0 0 0 0 0 0
  19504. -1.2785 -0.0014 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19505. -0.9129 -0.0615 1.1405 C 0 0 0 0 0 0 0 0 0 0 0 0
  19506. 0.3682 -0.0711 1.5691 N 0 0 0 0 0 0 0 0 0 0 0 0
  19507. 1.3253 -0.0182 0.6173 C 0 0 0 0 0 0 0 0 0 0 0 0
  19508. 1.0589 0.0438 -0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0
  19509. -0.5180 0.1000 -2.2078 H 0 0 0 0 0 0 0 0 0 0 0 0
  19510. -2.3238 0.0035 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  19511. -1.6631 -0.1047 1.9247 H 0 0 0 0 0 0 0 0 0 0 0 0
  19512. 2.3464 -0.0272 0.9874 H 0 0 0 0 0 0 0 0 0 0 0 0
  19513. 1.8678 0.0846 -1.4617 H 0 0 0 0 0 0 0 0 0 0 0 0
  19514. 1 2 2 0
  19515. 2 3 1 0
  19516. 3 4 2 0
  19517. 4 5 1 0
  19518. 5 6 2 0
  19519. 6 1 1 0
  19520. 1 7 1 0
  19521. 2 8 1 0
  19522. 3 9 1 0
  19523. 5 10 1 0
  19524. 6 11 1 0
  19525. M END
  19526. $$$$
  19527. RDKit 3D
  19528. 11 11 0 0 0 0 0 0 0 0999 V2000
  19529. -0.2702 0.0594 -1.1511 C 0 0 0 0 0 0 0 0 0 0 0 0
  19530. -1.2785 -0.0002 -0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0
  19531. -0.9129 -0.0686 1.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
  19532. 0.3682 -0.0810 1.5686 N 0 0 0 0 0 0 0 0 0 0 0 0
  19533. 1.3253 -0.0221 0.6172 C 0 0 0 0 0 0 0 0 0 0 0 0
  19534. 1.0589 0.0485 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0
  19535. -0.5180 0.1139 -2.2072 H 0 0 0 0 0 0 0 0 0 0 0 0
  19536. -2.3238 0.0065 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0
  19537. -1.6631 -0.1168 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0
  19538. 2.3464 -0.0334 0.9872 H 0 0 0 0 0 0 0 0 0 0 0 0
  19539. 1.8678 0.0937 -1.4612 H 0 0 0 0 0 0 0 0 0 0 0 0
  19540. 1 2 2 0
  19541. 2 3 1 0
  19542. 3 4 2 0
  19543. 4 5 1 0
  19544. 5 6 2 0
  19545. 6 1 1 0
  19546. 1 7 1 0
  19547. 2 8 1 0
  19548. 3 9 1 0
  19549. 5 10 1 0
  19550. 6 11 1 0
  19551. M END
  19552. $$$$
  19553. RDKit 3D
  19554. 11 11 0 0 0 0 0 0 0 0999 V2000
  19555. -0.2702 0.0666 -1.1507 C 0 0 0 0 0 0 0 0 0 0 0 0
  19556. -1.2785 0.0011 -0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0
  19557. -0.9129 -0.0758 1.1396 C 0 0 0 0 0 0 0 0 0 0 0 0
  19558. 0.3682 -0.0908 1.5681 N 0 0 0 0 0 0 0 0 0 0 0 0
  19559. 1.3253 -0.0259 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0
  19560. 1.0589 0.0531 -0.7406 C 0 0 0 0 0 0 0 0 0 0 0 0
  19561. -0.5180 0.1278 -2.2064 H 0 0 0 0 0 0 0 0 0 0 0 0
  19562. -2.3238 0.0096 -0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
  19563. -1.6631 -0.1289 1.9232 H 0 0 0 0 0 0 0 0 0 0 0 0
  19564. 2.3464 -0.0396 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0
  19565. 1.8678 0.1029 -1.4605 H 0 0 0 0 0 0 0 0 0 0 0 0
  19566. 1 2 2 0
  19567. 2 3 1 0
  19568. 3 4 2 0
  19569. 4 5 1 0
  19570. 5 6 2 0
  19571. 6 1 1 0
  19572. 1 7 1 0
  19573. 2 8 1 0
  19574. 3 9 1 0
  19575. 5 10 1 0
  19576. 6 11 1 0
  19577. M END
  19578. $$$$
  19579. RDKit 3D
  19580. 11 11 0 0 0 0 0 0 0 0999 V2000
  19581. -0.2702 0.0739 -1.1503 C 0 0 0 0 0 0 0 0 0 0 0 0
  19582. -1.2785 0.0023 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19583. -0.9129 -0.0829 1.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
  19584. 0.3682 -0.1007 1.5675 N 0 0 0 0 0 0 0 0 0 0 0 0
  19585. 1.3253 -0.0298 0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0
  19586. 1.0589 0.0578 -0.7403 C 0 0 0 0 0 0 0 0 0 0 0 0
  19587. -0.5180 0.1416 -2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0
  19588. -2.3238 0.0126 -0.4817 H 0 0 0 0 0 0 0 0 0 0 0 0
  19589. -1.6631 -0.1410 1.9224 H 0 0 0 0 0 0 0 0 0 0 0 0
  19590. 2.3464 -0.0458 0.9867 H 0 0 0 0 0 0 0 0 0 0 0 0
  19591. 1.8678 0.1121 -1.4599 H 0 0 0 0 0 0 0 0 0 0 0 0
  19592. 1 2 2 0
  19593. 2 3 1 0
  19594. 3 4 2 0
  19595. 4 5 1 0
  19596. 5 6 2 0
  19597. 6 1 1 0
  19598. 1 7 1 0
  19599. 2 8 1 0
  19600. 3 9 1 0
  19601. 5 10 1 0
  19602. 6 11 1 0
  19603. M END
  19604. $$$$
  19605. RDKit 3D
  19606. 11 11 0 0 0 0 0 0 0 0999 V2000
  19607. -0.2702 0.0811 -1.1498 C 0 0 0 0 0 0 0 0 0 0 0 0
  19608. -1.2785 0.0035 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19609. -0.9129 -0.0901 1.1386 C 0 0 0 0 0 0 0 0 0 0 0 0
  19610. 0.3682 -0.1105 1.5668 N 0 0 0 0 0 0 0 0 0 0 0 0
  19611. 1.3253 -0.0337 0.6166 C 0 0 0 0 0 0 0 0 0 0 0 0
  19612. 1.0589 0.0624 -0.7399 C 0 0 0 0 0 0 0 0 0 0 0 0
  19613. -0.5180 0.1555 -2.2046 H 0 0 0 0 0 0 0 0 0 0 0 0
  19614. -2.3238 0.0156 -0.4816 H 0 0 0 0 0 0 0 0 0 0 0 0
  19615. -1.6631 -0.1531 1.9214 H 0 0 0 0 0 0 0 0 0 0 0 0
  19616. 2.3464 -0.0520 0.9864 H 0 0 0 0 0 0 0 0 0 0 0 0
  19617. 1.8678 0.1213 -1.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
  19618. 1 2 2 0
  19619. 2 3 1 0
  19620. 3 4 2 0
  19621. 4 5 1 0
  19622. 5 6 2 0
  19623. 6 1 1 0
  19624. 1 7 1 0
  19625. 2 8 1 0
  19626. 3 9 1 0
  19627. 5 10 1 0
  19628. 6 11 1 0
  19629. M END
  19630. $$$$
  19631. RDKit 3D
  19632. 11 11 0 0 0 0 0 0 0 0999 V2000
  19633. -0.2702 0.0883 -1.1493 C 0 0 0 0 0 0 0 0 0 0 0 0
  19634. -1.2785 0.0047 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19635. -0.9129 -0.0973 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0
  19636. 0.3682 -0.1203 1.5661 N 0 0 0 0 0 0 0 0 0 0 0 0
  19637. 1.3253 -0.0376 0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0
  19638. 1.0589 0.0671 -0.7395 C 0 0 0 0 0 0 0 0 0 0 0 0
  19639. -0.5180 0.1693 -2.2036 H 0 0 0 0 0 0 0 0 0 0 0 0
  19640. -2.3238 0.0186 -0.4815 H 0 0 0 0 0 0 0 0 0 0 0 0
  19641. -1.6631 -0.1651 1.9205 H 0 0 0 0 0 0 0 0 0 0 0 0
  19642. 2.3464 -0.0582 0.9861 H 0 0 0 0 0 0 0 0 0 0 0 0
  19643. 1.8678 0.1304 -1.4583 H 0 0 0 0 0 0 0 0 0 0 0 0
  19644. 1 2 2 0
  19645. 2 3 1 0
  19646. 3 4 2 0
  19647. 4 5 1 0
  19648. 5 6 2 0
  19649. 6 1 1 0
  19650. 1 7 1 0
  19651. 2 8 1 0
  19652. 3 9 1 0
  19653. 5 10 1 0
  19654. 6 11 1 0
  19655. M END
  19656. $$$$
  19657. RDKit 3D
  19658. 11 11 0 0 0 0 0 0 0 0999 V2000
  19659. -0.2702 0.0955 -1.1487 C 0 0 0 0 0 0 0 0 0 0 0 0
  19660. -1.2785 0.0060 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
  19661. -0.9129 -0.1044 1.1374 C 0 0 0 0 0 0 0 0 0 0 0 0
  19662. 0.3682 -0.1302 1.5653 N 0 0 0 0 0 0 0 0 0 0 0 0
  19663. 1.3253 -0.0414 0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0
  19664. 1.0589 0.0717 -0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0
  19665. -0.5180 0.1832 -2.2025 H 0 0 0 0 0 0 0 0 0 0 0 0
  19666. -2.3238 0.0217 -0.4814 H 0 0 0 0 0 0 0 0 0 0 0 0
  19667. -1.6631 -0.1772 1.9194 H 0 0 0 0 0 0 0 0 0 0 0 0
  19668. 2.3464 -0.0644 0.9857 H 0 0 0 0 0 0 0 0 0 0 0 0
  19669. 1.8678 0.1396 -1.4575 H 0 0 0 0 0 0 0 0 0 0 0 0
  19670. 1 2 2 0
  19671. 2 3 1 0
  19672. 3 4 2 0
  19673. 4 5 1 0
  19674. 5 6 2 0
  19675. 6 1 1 0
  19676. 1 7 1 0
  19677. 2 8 1 0
  19678. 3 9 1 0
  19679. 5 10 1 0
  19680. 6 11 1 0
  19681. M END
  19682. $$$$
  19683. RDKit 3D
  19684. 11 11 0 0 0 0 0 0 0 0999 V2000
  19685. -0.2702 0.1027 -1.1481 C 0 0 0 0 0 0 0 0 0 0 0 0
  19686. -1.2785 0.0072 -0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  19687. -0.9129 -0.1115 1.1367 C 0 0 0 0 0 0 0 0 0 0 0 0
  19688. 0.3682 -0.1400 1.5645 N 0 0 0 0 0 0 0 0 0 0 0 0
  19689. 1.3253 -0.0453 0.6159 C 0 0 0 0 0 0 0 0 0 0 0 0
  19690. 1.0589 0.0764 -0.7386 C 0 0 0 0 0 0 0 0 0 0 0 0
  19691. -0.5180 0.1970 -2.2013 H 0 0 0 0 0 0 0 0 0 0 0 0
  19692. -2.3238 0.0247 -0.4813 H 0 0 0 0 0 0 0 0 0 0 0 0
  19693. -1.6631 -0.1893 1.9182 H 0 0 0 0 0 0 0 0 0 0 0 0
  19694. 2.3464 -0.0706 0.9853 H 0 0 0 0 0 0 0 0 0 0 0 0
  19695. 1.8678 0.1487 -1.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
  19696. 1 2 2 0
  19697. 2 3 1 0
  19698. 3 4 2 0
  19699. 4 5 1 0
  19700. 5 6 2 0
  19701. 6 1 1 0
  19702. 1 7 1 0
  19703. 2 8 1 0
  19704. 3 9 1 0
  19705. 5 10 1 0
  19706. 6 11 1 0
  19707. M END
  19708. $$$$
  19709. RDKit 3D
  19710. 11 11 0 0 0 0 0 0 0 0999 V2000
  19711. -0.2702 0.1100 -1.1474 C 0 0 0 0 0 0 0 0 0 0 0 0
  19712. -1.2785 0.0084 -0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
  19713. -0.9129 -0.1187 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0
  19714. 0.3682 -0.1498 1.5636 N 0 0 0 0 0 0 0 0 0 0 0 0
  19715. 1.3253 -0.0492 0.6156 C 0 0 0 0 0 0 0 0 0 0 0 0
  19716. 1.0589 0.0810 -0.7381 C 0 0 0 0 0 0 0 0 0 0 0 0
  19717. -0.5180 0.2108 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  19718. -2.3238 0.0277 -0.4811 H 0 0 0 0 0 0 0 0 0 0 0 0
  19719. -1.6631 -0.2013 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
  19720. 2.3464 -0.0768 0.9848 H 0 0 0 0 0 0 0 0 0 0 0 0
  19721. 1.8678 0.1579 -1.4556 H 0 0 0 0 0 0 0 0 0 0 0 0
  19722. 1 2 2 0
  19723. 2 3 1 0
  19724. 3 4 2 0
  19725. 4 5 1 0
  19726. 5 6 2 0
  19727. 6 1 1 0
  19728. 1 7 1 0
  19729. 2 8 1 0
  19730. 3 9 1 0
  19731. 5 10 1 0
  19732. 6 11 1 0
  19733. M END
  19734. $$$$
  19735. RDKit 3D
  19736. 11 11 0 0 0 0 0 0 0 0999 V2000
  19737. -0.2702 0.1172 -1.1467 C 0 0 0 0 0 0 0 0 0 0 0 0
  19738. -1.2785 0.0096 -0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
  19739. -0.9129 -0.1258 1.1352 C 0 0 0 0 0 0 0 0 0 0 0 0
  19740. 0.3682 -0.1597 1.5626 N 0 0 0 0 0 0 0 0 0 0 0 0
  19741. 1.3253 -0.0530 0.6153 C 0 0 0 0 0 0 0 0 0 0 0 0
  19742. 1.0589 0.0856 -0.7376 C 0 0 0 0 0 0 0 0 0 0 0 0
  19743. -0.5180 0.2247 -2.1987 H 0 0 0 0 0 0 0 0 0 0 0 0
  19744. -2.3238 0.0307 -0.4809 H 0 0 0 0 0 0 0 0 0 0 0 0
  19745. -1.6631 -0.2134 1.9157 H 0 0 0 0 0 0 0 0 0 0 0 0
  19746. 2.3464 -0.0830 0.9843 H 0 0 0 0 0 0 0 0 0 0 0 0
  19747. 1.8678 0.1670 -1.4546 H 0 0 0 0 0 0 0 0 0 0 0 0
  19748. 1 2 2 0
  19749. 2 3 1 0
  19750. 3 4 2 0
  19751. 4 5 1 0
  19752. 5 6 2 0
  19753. 6 1 1 0
  19754. 1 7 1 0
  19755. 2 8 1 0
  19756. 3 9 1 0
  19757. 5 10 1 0
  19758. 6 11 1 0
  19759. M END
  19760. $$$$
  19761. RDKit 3D
  19762. 11 11 0 0 0 0 0 0 0 0999 V2000
  19763. -0.2702 0.1244 -1.1459 C 0 0 0 0 0 0 0 0 0 0 0 0
  19764. -1.2785 0.0108 -0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
  19765. -0.9129 -0.1330 1.1344 C 0 0 0 0 0 0 0 0 0 0 0 0
  19766. 0.3682 -0.1695 1.5616 N 0 0 0 0 0 0 0 0 0 0 0 0
  19767. 1.3253 -0.0569 0.6149 C 0 0 0 0 0 0 0 0 0 0 0 0
  19768. 1.0589 0.0903 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0
  19769. -0.5180 0.2385 -2.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
  19770. -2.3238 0.0338 -0.4807 H 0 0 0 0 0 0 0 0 0 0 0 0
  19771. -1.6631 -0.2254 1.9143 H 0 0 0 0 0 0 0 0 0 0 0 0
  19772. 2.3464 -0.0892 0.9838 H 0 0 0 0 0 0 0 0 0 0 0 0
  19773. 1.8678 0.1762 -1.4535 H 0 0 0 0 0 0 0 0 0 0 0 0
  19774. 1 2 2 0
  19775. 2 3 1 0
  19776. 3 4 2 0
  19777. 4 5 1 0
  19778. 5 6 2 0
  19779. 6 1 1 0
  19780. 1 7 1 0
  19781. 2 8 1 0
  19782. 3 9 1 0
  19783. 5 10 1 0
  19784. 6 11 1 0
  19785. M END
  19786. $$$$
  19787. RDKit 3D
  19788. 11 11 0 0 0 0 0 0 0 0999 V2000
  19789. -0.2702 0.1316 -1.1451 C 0 0 0 0 0 0 0 0 0 0 0 0
  19790. -1.2785 0.0121 -0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0
  19791. -0.9129 -0.1401 1.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
  19792. 0.3682 -0.1793 1.5605 N 0 0 0 0 0 0 0 0 0 0 0 0
  19793. 1.3253 -0.0608 0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0
  19794. 1.0589 0.0949 -0.7365 C 0 0 0 0 0 0 0 0 0 0 0 0
  19795. -0.5180 0.2523 -2.1957 H 0 0 0 0 0 0 0 0 0 0 0 0
  19796. -2.3238 0.0368 -0.4805 H 0 0 0 0 0 0 0 0 0 0 0 0
  19797. -1.6631 -0.2374 1.9129 H 0 0 0 0 0 0 0 0 0 0 0 0
  19798. 2.3464 -0.0953 0.9832 H 0 0 0 0 0 0 0 0 0 0 0 0
  19799. 1.8678 0.1853 -1.4524 H 0 0 0 0 0 0 0 0 0 0 0 0
  19800. 1 2 2 0
  19801. 2 3 1 0
  19802. 3 4 2 0
  19803. 4 5 1 0
  19804. 5 6 2 0
  19805. 6 1 1 0
  19806. 1 7 1 0
  19807. 2 8 1 0
  19808. 3 9 1 0
  19809. 5 10 1 0
  19810. 6 11 1 0
  19811. M END
  19812. $$$$
  19813. RDKit 3D
  19814. 11 11 0 0 0 0 0 0 0 0999 V2000
  19815. -0.2702 0.1388 -1.1443 C 0 0 0 0 0 0 0 0 0 0 0 0
  19816. -1.2785 0.0133 -0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0
  19817. -0.9129 -0.1472 1.1326 C 0 0 0 0 0 0 0 0 0 0 0 0
  19818. 0.3682 -0.1891 1.5593 N 0 0 0 0 0 0 0 0 0 0 0 0
  19819. 1.3253 -0.0646 0.6142 C 0 0 0 0 0 0 0 0 0 0 0 0
  19820. 1.0589 0.0995 -0.7358 C 0 0 0 0 0 0 0 0 0 0 0 0
  19821. -0.5180 0.2661 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
  19822. -2.3238 0.0398 -0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
  19823. -1.6631 -0.2494 1.9113 H 0 0 0 0 0 0 0 0 0 0 0 0
  19824. 2.3464 -0.1015 0.9826 H 0 0 0 0 0 0 0 0 0 0 0 0
  19825. 1.8678 0.1944 -1.4512 H 0 0 0 0 0 0 0 0 0 0 0 0
  19826. 1 2 2 0
  19827. 2 3 1 0
  19828. 3 4 2 0
  19829. 4 5 1 0
  19830. 5 6 2 0
  19831. 6 1 1 0
  19832. 1 7 1 0
  19833. 2 8 1 0
  19834. 3 9 1 0
  19835. 5 10 1 0
  19836. 6 11 1 0
  19837. M END
  19838. $$$$
  19839. RDKit 3D
  19840. 11 11 0 0 0 0 0 0 0 0999 V2000
  19841. -0.2702 0.1459 -1.1434 C 0 0 0 0 0 0 0 0 0 0 0 0
  19842. -1.2785 0.0145 -0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0
  19843. -0.9129 -0.1543 1.1317 C 0 0 0 0 0 0 0 0 0 0 0 0
  19844. 0.3682 -0.1989 1.5581 N 0 0 0 0 0 0 0 0 0 0 0 0
  19845. 1.3253 -0.0685 0.6138 C 0 0 0 0 0 0 0 0 0 0 0 0
  19846. 1.0589 0.1041 -0.7352 C 0 0 0 0 0 0 0 0 0 0 0 0
  19847. -0.5180 0.2798 -2.1923 H 0 0 0 0 0 0 0 0 0 0 0 0
  19848. -2.3238 0.0428 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0
  19849. -1.6631 -0.2614 1.9097 H 0 0 0 0 0 0 0 0 0 0 0 0
  19850. 2.3464 -0.1077 0.9819 H 0 0 0 0 0 0 0 0 0 0 0 0
  19851. 1.8678 0.2035 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0
  19852. 1 2 2 0
  19853. 2 3 1 0
  19854. 3 4 2 0
  19855. 4 5 1 0
  19856. 5 6 2 0
  19857. 6 1 1 0
  19858. 1 7 1 0
  19859. 2 8 1 0
  19860. 3 9 1 0
  19861. 5 10 1 0
  19862. 6 11 1 0
  19863. M END
  19864. $$$$
  19865. RDKit 3D
  19866. 11 11 0 0 0 0 0 0 0 0999 V2000
  19867. -0.2702 0.1531 -1.1424 C 0 0 0 0 0 0 0 0 0 0 0 0
  19868. -1.2785 0.0157 -0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0
  19869. -0.9129 -0.1614 1.1307 C 0 0 0 0 0 0 0 0 0 0 0 0
  19870. 0.3682 -0.2087 1.5568 N 0 0 0 0 0 0 0 0 0 0 0 0
  19871. 1.3253 -0.0723 0.6133 C 0 0 0 0 0 0 0 0 0 0 0 0
  19872. 1.0589 0.1088 -0.7345 C 0 0 0 0 0 0 0 0 0 0 0 0
  19873. -0.5180 0.2936 -2.1905 H 0 0 0 0 0 0 0 0 0 0 0 0
  19874. -2.3238 0.0458 -0.4797 H 0 0 0 0 0 0 0 0 0 0 0 0
  19875. -1.6631 -0.2734 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0
  19876. 2.3464 -0.1138 0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0
  19877. 1.8678 0.2126 -1.4486 H 0 0 0 0 0 0 0 0 0 0 0 0
  19878. 1 2 2 0
  19879. 2 3 1 0
  19880. 3 4 2 0
  19881. 4 5 1 0
  19882. 5 6 2 0
  19883. 6 1 1 0
  19884. 1 7 1 0
  19885. 2 8 1 0
  19886. 3 9 1 0
  19887. 5 10 1 0
  19888. 6 11 1 0
  19889. M END
  19890. $$$$
  19891. RDKit 3D
  19892. 11 11 0 0 0 0 0 0 0 0999 V2000
  19893. -0.2702 0.1603 -1.1414 C 0 0 0 0 0 0 0 0 0 0 0 0
  19894. -1.2785 0.0170 -0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
  19895. -0.9129 -0.1685 1.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
  19896. 0.3682 -0.2184 1.5555 N 0 0 0 0 0 0 0 0 0 0 0 0
  19897. 1.3253 -0.0762 0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0
  19898. 1.0589 0.1134 -0.7338 C 0 0 0 0 0 0 0 0 0 0 0 0
  19899. -0.5180 0.3074 -2.1886 H 0 0 0 0 0 0 0 0 0 0 0 0
  19900. -2.3238 0.0488 -0.4794 H 0 0 0 0 0 0 0 0 0 0 0 0
  19901. -1.6631 -0.2854 1.9063 H 0 0 0 0 0 0 0 0 0 0 0 0
  19902. 2.3464 -0.1200 0.9805 H 0 0 0 0 0 0 0 0 0 0 0 0
  19903. 1.8678 0.2217 -1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0
  19904. 1 2 2 0
  19905. 2 3 1 0
  19906. 3 4 2 0
  19907. 4 5 1 0
  19908. 5 6 2 0
  19909. 6 1 1 0
  19910. 1 7 1 0
  19911. 2 8 1 0
  19912. 3 9 1 0
  19913. 5 10 1 0
  19914. 6 11 1 0
  19915. M END
  19916. $$$$
  19917. RDKit 3D
  19918. 11 11 0 0 0 0 0 0 0 0999 V2000
  19919. -0.2702 0.1675 -1.1404 C 0 0 0 0 0 0 0 0 0 0 0 0
  19920. -1.2785 0.0182 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0
  19921. -0.9129 -0.1756 1.1286 C 0 0 0 0 0 0 0 0 0 0 0 0
  19922. 0.3682 -0.2282 1.5541 N 0 0 0 0 0 0 0 0 0 0 0 0
  19923. 1.3253 -0.0800 0.6124 C 0 0 0 0 0 0 0 0 0 0 0 0
  19924. 1.0589 0.1180 -0.7331 C 0 0 0 0 0 0 0 0 0 0 0 0
  19925. -0.5180 0.3211 -2.1867 H 0 0 0 0 0 0 0 0 0 0 0 0
  19926. -2.3238 0.0519 -0.4791 H 0 0 0 0 0 0 0 0 0 0 0 0
  19927. -1.6631 -0.2974 1.9045 H 0 0 0 0 0 0 0 0 0 0 0 0
  19928. 2.3464 -0.1262 0.9797 H 0 0 0 0 0 0 0 0 0 0 0 0
  19929. 1.8678 0.2308 -1.4459 H 0 0 0 0 0 0 0 0 0 0 0 0
  19930. 1 2 2 0
  19931. 2 3 1 0
  19932. 3 4 2 0
  19933. 4 5 1 0
  19934. 5 6 2 0
  19935. 6 1 1 0
  19936. 1 7 1 0
  19937. 2 8 1 0
  19938. 3 9 1 0
  19939. 5 10 1 0
  19940. 6 11 1 0
  19941. M END
  19942. $$$$
  19943. RDKit 3D
  19944. 11 11 0 0 0 0 0 0 0 0999 V2000
  19945. -0.2702 0.1746 -1.1393 C 0 0 0 0 0 0 0 0 0 0 0 0
  19946. -1.2785 0.0194 -0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0
  19947. -0.9129 -0.1827 1.1274 C 0 0 0 0 0 0 0 0 0 0 0 0
  19948. 0.3682 -0.2380 1.5526 N 0 0 0 0 0 0 0 0 0 0 0 0
  19949. 1.3253 -0.0839 0.6118 C 0 0 0 0 0 0 0 0 0 0 0 0
  19950. 1.0589 0.1226 -0.7324 C 0 0 0 0 0 0 0 0 0 0 0 0
  19951. -0.5180 0.3348 -2.1846 H 0 0 0 0 0 0 0 0 0 0 0 0
  19952. -2.3238 0.0549 -0.4788 H 0 0 0 0 0 0 0 0 0 0 0 0
  19953. -1.6631 -0.3093 1.9026 H 0 0 0 0 0 0 0 0 0 0 0 0
  19954. 2.3464 -0.1323 0.9789 H 0 0 0 0 0 0 0 0 0 0 0 0
  19955. 1.8678 0.2399 -1.4444 H 0 0 0 0 0 0 0 0 0 0 0 0
  19956. 1 2 2 0
  19957. 2 3 1 0
  19958. 3 4 2 0
  19959. 4 5 1 0
  19960. 5 6 2 0
  19961. 6 1 1 0
  19962. 1 7 1 0
  19963. 2 8 1 0
  19964. 3 9 1 0
  19965. 5 10 1 0
  19966. 6 11 1 0
  19967. M END
  19968. $$$$
  19969. RDKit 3D
  19970. 11 11 0 0 0 0 0 0 0 0999 V2000
  19971. -0.2702 0.1818 -1.1382 C 0 0 0 0 0 0 0 0 0 0 0 0
  19972. -1.2785 0.0206 -0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0
  19973. -0.9129 -0.1898 1.1263 C 0 0 0 0 0 0 0 0 0 0 0 0
  19974. 0.3682 -0.2477 1.5511 N 0 0 0 0 0 0 0 0 0 0 0 0
  19975. 1.3253 -0.0877 0.6113 C 0 0 0 0 0 0 0 0 0 0 0 0
  19976. 1.0589 0.1272 -0.7316 C 0 0 0 0 0 0 0 0 0 0 0 0
  19977. -0.5180 0.3486 -2.1824 H 0 0 0 0 0 0 0 0 0 0 0 0
  19978. -2.3238 0.0579 -0.4784 H 0 0 0 0 0 0 0 0 0 0 0 0
  19979. -1.6631 -0.3213 1.9006 H 0 0 0 0 0 0 0 0 0 0 0 0
  19980. 2.3464 -0.1385 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
  19981. 1.8678 0.2490 -1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0
  19982. 1 2 2 0
  19983. 2 3 1 0
  19984. 3 4 2 0
  19985. 4 5 1 0
  19986. 5 6 2 0
  19987. 6 1 1 0
  19988. 1 7 1 0
  19989. 2 8 1 0
  19990. 3 9 1 0
  19991. 5 10 1 0
  19992. 6 11 1 0
  19993. M END
  19994. $$$$
  19995. RDKit 3D
  19996. 11 11 0 0 0 0 0 0 0 0999 V2000
  19997. -0.2702 0.1889 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  19998. -1.2785 0.0218 -0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0
  19999. -0.9129 -0.1969 1.1251 C 0 0 0 0 0 0 0 0 0 0 0 0
  20000. 0.3682 -0.2575 1.5495 N 0 0 0 0 0 0 0 0 0 0 0 0
  20001. 1.3253 -0.0916 0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0
  20002. 1.0589 0.1318 -0.7308 C 0 0 0 0 0 0 0 0 0 0 0 0
  20003. -0.5180 0.3623 -2.1802 H 0 0 0 0 0 0 0 0 0 0 0 0
  20004. -2.3238 0.0609 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
  20005. -1.6631 -0.3332 1.8985 H 0 0 0 0 0 0 0 0 0 0 0 0
  20006. 2.3464 -0.1446 0.9771 H 0 0 0 0 0 0 0 0 0 0 0 0
  20007. 1.8678 0.2580 -1.4412 H 0 0 0 0 0 0 0 0 0 0 0 0
  20008. 1 2 2 0
  20009. 2 3 1 0
  20010. 3 4 2 0
  20011. 4 5 1 0
  20012. 5 6 2 0
  20013. 6 1 1 0
  20014. 1 7 1 0
  20015. 2 8 1 0
  20016. 3 9 1 0
  20017. 5 10 1 0
  20018. 6 11 1 0
  20019. M END
  20020. $$$$
  20021. RDKit 3D
  20022. 11 11 0 0 0 0 0 0 0 0999 V2000
  20023. -0.2702 0.1961 -1.1358 C 0 0 0 0 0 0 0 0 0 0 0 0
  20024. -1.2785 0.0230 -0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0
  20025. -0.9129 -0.2039 1.1238 C 0 0 0 0 0 0 0 0 0 0 0 0
  20026. 0.3682 -0.2672 1.5478 N 0 0 0 0 0 0 0 0 0 0 0 0
  20027. 1.3253 -0.0954 0.6101 C 0 0 0 0 0 0 0 0 0 0 0 0
  20028. 1.0589 0.1364 -0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0
  20029. -0.5180 0.3760 -2.1779 H 0 0 0 0 0 0 0 0 0 0 0 0
  20030. -2.3238 0.0639 -0.4776 H 0 0 0 0 0 0 0 0 0 0 0 0
  20031. -1.6631 -0.3451 1.8964 H 0 0 0 0 0 0 0 0 0 0 0 0
  20032. 2.3464 -0.1507 0.9762 H 0 0 0 0 0 0 0 0 0 0 0 0
  20033. 1.8678 0.2671 -1.4396 H 0 0 0 0 0 0 0 0 0 0 0 0
  20034. 1 2 2 0
  20035. 2 3 1 0
  20036. 3 4 2 0
  20037. 4 5 1 0
  20038. 5 6 2 0
  20039. 6 1 1 0
  20040. 1 7 1 0
  20041. 2 8 1 0
  20042. 3 9 1 0
  20043. 5 10 1 0
  20044. 6 11 1 0
  20045. M END
  20046. $$$$
  20047. RDKit 3D
  20048. 11 11 0 0 0 0 0 0 0 0999 V2000
  20049. -0.2702 0.2032 -1.1346 C 0 0 0 0 0 0 0 0 0 0 0 0
  20050. -1.2785 0.0243 -0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0
  20051. -0.9129 -0.2110 1.1225 C 0 0 0 0 0 0 0 0 0 0 0 0
  20052. 0.3682 -0.2769 1.5461 N 0 0 0 0 0 0 0 0 0 0 0 0
  20053. 1.3253 -0.0992 0.6095 C 0 0 0 0 0 0 0 0 0 0 0 0
  20054. 1.0589 0.1409 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0
  20055. -0.5180 0.3896 -2.1755 H 0 0 0 0 0 0 0 0 0 0 0 0
  20056. -2.3238 0.0669 -0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0
  20057. -1.6631 -0.3571 1.8942 H 0 0 0 0 0 0 0 0 0 0 0 0
  20058. 2.3464 -0.1569 0.9752 H 0 0 0 0 0 0 0 0 0 0 0 0
  20059. 1.8678 0.2761 -1.4379 H 0 0 0 0 0 0 0 0 0 0 0 0
  20060. 1 2 2 0
  20061. 2 3 1 0
  20062. 3 4 2 0
  20063. 4 5 1 0
  20064. 5 6 2 0
  20065. 6 1 1 0
  20066. 1 7 1 0
  20067. 2 8 1 0
  20068. 3 9 1 0
  20069. 5 10 1 0
  20070. 6 11 1 0
  20071. M END
  20072. $$$$
  20073. RDKit 3D
  20074. 11 11 0 0 0 0 0 0 0 0999 V2000
  20075. -0.2702 0.2103 -1.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
  20076. -1.2785 0.0255 -0.1932 C 0 0 0 0 0 0 0 0 0 0 0 0
  20077. -0.9129 -0.2180 1.1212 C 0 0 0 0 0 0 0 0 0 0 0 0
  20078. 0.3682 -0.2866 1.5444 N 0 0 0 0 0 0 0 0 0 0 0 0
  20079. 1.3253 -0.1031 0.6089 C 0 0 0 0 0 0 0 0 0 0 0 0
  20080. 1.0589 0.1455 -0.7281 C 0 0 0 0 0 0 0 0 0 0 0 0
  20081. -0.5180 0.4033 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  20082. -2.3238 0.0699 -0.4768 H 0 0 0 0 0 0 0 0 0 0 0 0
  20083. -1.6631 -0.3689 1.8919 H 0 0 0 0 0 0 0 0 0 0 0 0
  20084. 2.3464 -0.1630 0.9742 H 0 0 0 0 0 0 0 0 0 0 0 0
  20085. 1.8678 0.2852 -1.4361 H 0 0 0 0 0 0 0 0 0 0 0 0
  20086. 1 2 2 0
  20087. 2 3 1 0
  20088. 3 4 2 0
  20089. 4 5 1 0
  20090. 5 6 2 0
  20091. 6 1 1 0
  20092. 1 7 1 0
  20093. 2 8 1 0
  20094. 3 9 1 0
  20095. 5 10 1 0
  20096. 6 11 1 0
  20097. M END
  20098. $$$$
  20099. RDKit 3D
  20100. 11 11 0 0 0 0 0 0 0 0999 V2000
  20101. -0.2702 0.2175 -1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0
  20102. -1.2785 0.0267 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0
  20103. -0.9129 -0.2251 1.1198 C 0 0 0 0 0 0 0 0 0 0 0 0
  20104. 0.3682 -0.2963 1.5425 N 0 0 0 0 0 0 0 0 0 0 0 0
  20105. 1.3253 -0.1069 0.6082 C 0 0 0 0 0 0 0 0 0 0 0 0
  20106. 1.0589 0.1501 -0.7272 C 0 0 0 0 0 0 0 0 0 0 0 0
  20107. -0.5180 0.4169 -2.1704 H 0 0 0 0 0 0 0 0 0 0 0 0
  20108. -2.3238 0.0729 -0.4764 H 0 0 0 0 0 0 0 0 0 0 0 0
  20109. -1.6631 -0.3808 1.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
  20110. 2.3464 -0.1691 0.9732 H 0 0 0 0 0 0 0 0 0 0 0 0
  20111. 1.8678 0.2942 -1.4343 H 0 0 0 0 0 0 0 0 0 0 0 0
  20112. 1 2 2 0
  20113. 2 3 1 0
  20114. 3 4 2 0
  20115. 4 5 1 0
  20116. 5 6 2 0
  20117. 6 1 1 0
  20118. 1 7 1 0
  20119. 2 8 1 0
  20120. 3 9 1 0
  20121. 5 10 1 0
  20122. 6 11 1 0
  20123. M END
  20124. $$$$
  20125. RDKit 3D
  20126. 11 11 0 0 0 0 0 0 0 0999 V2000
  20127. -0.2702 0.2246 -1.1306 C 0 0 0 0 0 0 0 0 0 0 0 0
  20128. -1.2785 0.0279 -0.1928 C 0 0 0 0 0 0 0 0 0 0 0 0
  20129. -0.9129 -0.2321 1.1183 C 0 0 0 0 0 0 0 0 0 0 0 0
  20130. 0.3682 -0.3060 1.5406 N 0 0 0 0 0 0 0 0 0 0 0 0
  20131. 1.3253 -0.1107 0.6076 C 0 0 0 0 0 0 0 0 0 0 0 0
  20132. 1.0589 0.1547 -0.7263 C 0 0 0 0 0 0 0 0 0 0 0 0
  20133. -0.5180 0.4306 -2.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
  20134. -2.3238 0.0759 -0.4759 H 0 0 0 0 0 0 0 0 0 0 0 0
  20135. -1.6631 -0.3927 1.8871 H 0 0 0 0 0 0 0 0 0 0 0 0
  20136. 2.3464 -0.1752 0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0
  20137. 1.8678 0.3032 -1.4324 H 0 0 0 0 0 0 0 0 0 0 0 0
  20138. 1 2 2 0
  20139. 2 3 1 0
  20140. 3 4 2 0
  20141. 4 5 1 0
  20142. 5 6 2 0
  20143. 6 1 1 0
  20144. 1 7 1 0
  20145. 2 8 1 0
  20146. 3 9 1 0
  20147. 5 10 1 0
  20148. 6 11 1 0
  20149. M END
  20150. $$$$
  20151. RDKit 3D
  20152. 11 11 0 0 0 0 0 0 0 0999 V2000
  20153. -0.2702 0.2317 -1.1291 C 0 0 0 0 0 0 0 0 0 0 0 0
  20154. -1.2785 0.0291 -0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0
  20155. -0.9129 -0.2391 1.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
  20156. 0.3682 -0.3157 1.5387 N 0 0 0 0 0 0 0 0 0 0 0 0
  20157. 1.3253 -0.1145 0.6068 C 0 0 0 0 0 0 0 0 0 0 0 0
  20158. 1.0589 0.1592 -0.7253 C 0 0 0 0 0 0 0 0 0 0 0 0
  20159. -0.5180 0.4442 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  20160. -2.3238 0.0788 -0.4754 H 0 0 0 0 0 0 0 0 0 0 0 0
  20161. -1.6631 -0.4045 1.8846 H 0 0 0 0 0 0 0 0 0 0 0 0
  20162. 2.3464 -0.1813 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0
  20163. 1.8678 0.3122 -1.4305 H 0 0 0 0 0 0 0 0 0 0 0 0
  20164. 1 2 2 0
  20165. 2 3 1 0
  20166. 3 4 2 0
  20167. 4 5 1 0
  20168. 5 6 2 0
  20169. 6 1 1 0
  20170. 1 7 1 0
  20171. 2 8 1 0
  20172. 3 9 1 0
  20173. 5 10 1 0
  20174. 6 11 1 0
  20175. M END
  20176. $$$$
  20177. RDKit 3D
  20178. 11 11 0 0 0 0 0 0 0 0999 V2000
  20179. -0.2702 0.2387 -1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
  20180. -1.2785 0.0303 -0.1925 C 0 0 0 0 0 0 0 0 0 0 0 0
  20181. -0.9129 -0.2461 1.1153 C 0 0 0 0 0 0 0 0 0 0 0 0
  20182. 0.3682 -0.3253 1.5367 N 0 0 0 0 0 0 0 0 0 0 0 0
  20183. 1.3253 -0.1183 0.6061 C 0 0 0 0 0 0 0 0 0 0 0 0
  20184. 1.0589 0.1638 -0.7243 C 0 0 0 0 0 0 0 0 0 0 0 0
  20185. -0.5180 0.4578 -2.1622 H 0 0 0 0 0 0 0 0 0 0 0 0
  20186. -2.3238 0.0818 -0.4749 H 0 0 0 0 0 0 0 0 0 0 0 0
  20187. -1.6631 -0.4164 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0
  20188. 2.3464 -0.1874 0.9698 H 0 0 0 0 0 0 0 0 0 0 0 0
  20189. 1.8678 0.3212 -1.4285 H 0 0 0 0 0 0 0 0 0 0 0 0
  20190. 1 2 2 0
  20191. 2 3 1 0
  20192. 3 4 2 0
  20193. 4 5 1 0
  20194. 5 6 2 0
  20195. 6 1 1 0
  20196. 1 7 1 0
  20197. 2 8 1 0
  20198. 3 9 1 0
  20199. 5 10 1 0
  20200. 6 11 1 0
  20201. M END
  20202. $$$$
  20203. RDKit 3D
  20204. 11 11 0 0 0 0 0 0 0 0999 V2000
  20205. -0.2702 0.2458 -1.1261 C 0 0 0 0 0 0 0 0 0 0 0 0
  20206. -1.2785 0.0315 -0.1923 C 0 0 0 0 0 0 0 0 0 0 0 0
  20207. -0.9129 -0.2531 1.1137 C 0 0 0 0 0 0 0 0 0 0 0 0
  20208. 0.3682 -0.3350 1.5346 N 0 0 0 0 0 0 0 0 0 0 0 0
  20209. 1.3253 -0.1221 0.6054 C 0 0 0 0 0 0 0 0 0 0 0 0
  20210. 1.0589 0.1683 -0.7232 C 0 0 0 0 0 0 0 0 0 0 0 0
  20211. -0.5180 0.4714 -2.1593 H 0 0 0 0 0 0 0 0 0 0 0 0
  20212. -2.3238 0.0848 -0.4744 H 0 0 0 0 0 0 0 0 0 0 0 0
  20213. -1.6631 -0.4282 1.8794 H 0 0 0 0 0 0 0 0 0 0 0 0
  20214. 2.3464 -0.1935 0.9686 H 0 0 0 0 0 0 0 0 0 0 0 0
  20215. 1.8678 0.3301 -1.4265 H 0 0 0 0 0 0 0 0 0 0 0 0
  20216. 1 2 2 0
  20217. 2 3 1 0
  20218. 3 4 2 0
  20219. 4 5 1 0
  20220. 5 6 2 0
  20221. 6 1 1 0
  20222. 1 7 1 0
  20223. 2 8 1 0
  20224. 3 9 1 0
  20225. 5 10 1 0
  20226. 6 11 1 0
  20227. M END
  20228. $$$$
  20229. RDKit 3D
  20230. 11 11 0 0 0 0 0 0 0 0999 V2000
  20231. -0.2702 0.2529 -1.1246 C 0 0 0 0 0 0 0 0 0 0 0 0
  20232. -1.2785 0.0327 -0.1921 C 0 0 0 0 0 0 0 0 0 0 0 0
  20233. -0.9129 -0.2601 1.1121 C 0 0 0 0 0 0 0 0 0 0 0 0
  20234. 0.3682 -0.3446 1.5325 N 0 0 0 0 0 0 0 0 0 0 0 0
  20235. 1.3253 -0.1259 0.6046 C 0 0 0 0 0 0 0 0 0 0 0 0
  20236. 1.0589 0.1729 -0.7221 C 0 0 0 0 0 0 0 0 0 0 0 0
  20237. -0.5180 0.4849 -2.1563 H 0 0 0 0 0 0 0 0 0 0 0 0
  20238. -2.3238 0.0878 -0.4738 H 0 0 0 0 0 0 0 0 0 0 0 0
  20239. -1.6631 -0.4400 1.8766 H 0 0 0 0 0 0 0 0 0 0 0 0
  20240. 2.3464 -0.1996 0.9674 H 0 0 0 0 0 0 0 0 0 0 0 0
  20241. 1.8678 0.3391 -1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0
  20242. 1 2 2 0
  20243. 2 3 1 0
  20244. 3 4 2 0
  20245. 4 5 1 0
  20246. 5 6 2 0
  20247. 6 1 1 0
  20248. 1 7 1 0
  20249. 2 8 1 0
  20250. 3 9 1 0
  20251. 5 10 1 0
  20252. 6 11 1 0
  20253. M END
  20254. $$$$
  20255. RDKit 3D
  20256. 11 11 0 0 0 0 0 0 0 0999 V2000
  20257. -0.2702 0.2600 -1.1229 C 0 0 0 0 0 0 0 0 0 0 0 0
  20258. -1.2785 0.0339 -0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0
  20259. -0.9129 -0.2671 1.1105 C 0 0 0 0 0 0 0 0 0 0 0 0
  20260. 0.3682 -0.3543 1.5303 N 0 0 0 0 0 0 0 0 0 0 0 0
  20261. 1.3253 -0.1297 0.6038 C 0 0 0 0 0 0 0 0 0 0 0 0
  20262. 1.0589 0.1774 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0
  20263. -0.5180 0.4985 -2.1532 H 0 0 0 0 0 0 0 0 0 0 0 0
  20264. -2.3238 0.0908 -0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0
  20265. -1.6631 -0.4518 1.8738 H 0 0 0 0 0 0 0 0 0 0 0 0
  20266. 2.3464 -0.2057 0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0
  20267. 1.8678 0.3480 -1.4222 H 0 0 0 0 0 0 0 0 0 0 0 0
  20268. 1 2 2 0
  20269. 2 3 1 0
  20270. 3 4 2 0
  20271. 4 5 1 0
  20272. 5 6 2 0
  20273. 6 1 1 0
  20274. 1 7 1 0
  20275. 2 8 1 0
  20276. 3 9 1 0
  20277. 5 10 1 0
  20278. 6 11 1 0
  20279. M END
  20280. $$$$
  20281. RDKit 3D
  20282. 11 11 0 0 0 0 0 0 0 0999 V2000
  20283. -0.2702 0.2670 -1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0
  20284. -1.2785 0.0351 -0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0
  20285. -0.9129 -0.2741 1.1088 C 0 0 0 0 0 0 0 0 0 0 0 0
  20286. 0.3682 -0.3639 1.5280 N 0 0 0 0 0 0 0 0 0 0 0 0
  20287. 1.3253 -0.1335 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0
  20288. 1.0589 0.1819 -0.7199 C 0 0 0 0 0 0 0 0 0 0 0 0
  20289. -0.5180 0.5120 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  20290. -2.3238 0.0937 -0.4727 H 0 0 0 0 0 0 0 0 0 0 0 0
  20291. -1.6631 -0.4635 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0
  20292. 2.3464 -0.2117 0.9648 H 0 0 0 0 0 0 0 0 0 0 0 0
  20293. 1.8678 0.3570 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  20294. 1 2 2 0
  20295. 2 3 1 0
  20296. 3 4 2 0
  20297. 4 5 1 0
  20298. 5 6 2 0
  20299. 6 1 1 0
  20300. 1 7 1 0
  20301. 2 8 1 0
  20302. 3 9 1 0
  20303. 5 10 1 0
  20304. 6 11 1 0
  20305. M END
  20306. $$$$
  20307. RDKit 3D
  20308. 11 11 0 0 0 0 0 0 0 0999 V2000
  20309. -0.2702 0.2741 -1.1196 C 0 0 0 0 0 0 0 0 0 0 0 0
  20310. -1.2785 0.0363 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0
  20311. -0.9129 -0.2810 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  20312. 0.3682 -0.3735 1.5257 N 0 0 0 0 0 0 0 0 0 0 0 0
  20313. 1.3253 -0.1373 0.6021 C 0 0 0 0 0 0 0 0 0 0 0 0
  20314. 1.0589 0.1864 -0.7188 C 0 0 0 0 0 0 0 0 0 0 0 0
  20315. -0.5180 0.5255 -2.1467 H 0 0 0 0 0 0 0 0 0 0 0 0
  20316. -2.3238 0.0967 -0.4721 H 0 0 0 0 0 0 0 0 0 0 0 0
  20317. -1.6631 -0.4753 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0
  20318. 2.3464 -0.2178 0.9635 H 0 0 0 0 0 0 0 0 0 0 0 0
  20319. 1.8678 0.3659 -1.4177 H 0 0 0 0 0 0 0 0 0 0 0 0
  20320. 1 2 2 0
  20321. 2 3 1 0
  20322. 3 4 2 0
  20323. 4 5 1 0
  20324. 5 6 2 0
  20325. 6 1 1 0
  20326. 1 7 1 0
  20327. 2 8 1 0
  20328. 3 9 1 0
  20329. 5 10 1 0
  20330. 6 11 1 0
  20331. M END
  20332. $$$$
  20333. RDKit 3D
  20334. 11 11 0 0 0 0 0 0 0 0999 V2000
  20335. -0.2702 0.2811 -1.1178 C 0 0 0 0 0 0 0 0 0 0 0 0
  20336. -1.2785 0.0376 -0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0
  20337. -0.9129 -0.2880 1.1052 C 0 0 0 0 0 0 0 0 0 0 0 0
  20338. 0.3682 -0.3830 1.5233 N 0 0 0 0 0 0 0 0 0 0 0 0
  20339. 1.3253 -0.1411 0.6012 C 0 0 0 0 0 0 0 0 0 0 0 0
  20340. 1.0589 0.1910 -0.7176 C 0 0 0 0 0 0 0 0 0 0 0 0
  20341. -0.5180 0.5389 -2.1434 H 0 0 0 0 0 0 0 0 0 0 0 0
  20342. -2.3238 0.0997 -0.4715 H 0 0 0 0 0 0 0 0 0 0 0 0
  20343. -1.6631 -0.4870 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0
  20344. 2.3464 -0.2239 0.9621 H 0 0 0 0 0 0 0 0 0 0 0 0
  20345. 1.8678 0.3748 -1.4154 H 0 0 0 0 0 0 0 0 0 0 0 0
  20346. 1 2 2 0
  20347. 2 3 1 0
  20348. 3 4 2 0
  20349. 4 5 1 0
  20350. 5 6 2 0
  20351. 6 1 1 0
  20352. 1 7 1 0
  20353. 2 8 1 0
  20354. 3 9 1 0
  20355. 5 10 1 0
  20356. 6 11 1 0
  20357. M END
  20358. $$$$
  20359. RDKit 3D
  20360. 11 11 0 0 0 0 0 0 0 0999 V2000
  20361. -0.2702 0.2881 -1.1161 C 0 0 0 0 0 0 0 0 0 0 0 0
  20362. -1.2785 0.0388 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
  20363. -0.9129 -0.2949 1.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
  20364. 0.3682 -0.3926 1.5209 N 0 0 0 0 0 0 0 0 0 0 0 0
  20365. 1.3253 -0.1449 0.6003 C 0 0 0 0 0 0 0 0 0 0 0 0
  20366. 1.0589 0.1955 -0.7164 C 0 0 0 0 0 0 0 0 0 0 0 0
  20367. -0.5180 0.5524 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  20368. -2.3238 0.1026 -0.4708 H 0 0 0 0 0 0 0 0 0 0 0 0
  20369. -1.6631 -0.4987 1.8619 H 0 0 0 0 0 0 0 0 0 0 0 0
  20370. 2.3464 -0.2299 0.9607 H 0 0 0 0 0 0 0 0 0 0 0 0
  20371. 1.8678 0.3837 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  20372. 1 2 2 0
  20373. 2 3 1 0
  20374. 3 4 2 0
  20375. 4 5 1 0
  20376. 5 6 2 0
  20377. 6 1 1 0
  20378. 1 7 1 0
  20379. 2 8 1 0
  20380. 3 9 1 0
  20381. 5 10 1 0
  20382. 6 11 1 0
  20383. M END
  20384. $$$$
  20385. RDKit 3D
  20386. 11 11 0 0 0 0 0 0 0 0999 V2000
  20387. -0.2702 0.2951 -1.1142 C 0 0 0 0 0 0 0 0 0 0 0 0
  20388. -1.2785 0.0400 -0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0
  20389. -0.9129 -0.3019 1.1015 C 0 0 0 0 0 0 0 0 0 0 0 0
  20390. 0.3682 -0.4021 1.5184 N 0 0 0 0 0 0 0 0 0 0 0 0
  20391. 1.3253 -0.1486 0.5994 C 0 0 0 0 0 0 0 0 0 0 0 0
  20392. 1.0589 0.2000 -0.7151 C 0 0 0 0 0 0 0 0 0 0 0 0
  20393. -0.5180 0.5658 -2.1364 H 0 0 0 0 0 0 0 0 0 0 0 0
  20394. -2.3238 0.1056 -0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0
  20395. -1.6631 -0.5104 1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0
  20396. 2.3464 -0.2359 0.9592 H 0 0 0 0 0 0 0 0 0 0 0 0
  20397. 1.8678 0.3925 -1.4106 H 0 0 0 0 0 0 0 0 0 0 0 0
  20398. 1 2 2 0
  20399. 2 3 1 0
  20400. 3 4 2 0
  20401. 4 5 1 0
  20402. 5 6 2 0
  20403. 6 1 1 0
  20404. 1 7 1 0
  20405. 2 8 1 0
  20406. 3 9 1 0
  20407. 5 10 1 0
  20408. 6 11 1 0
  20409. M END
  20410. $$$$
  20411. RDKit 3D
  20412. 11 11 0 0 0 0 0 0 0 0999 V2000
  20413. -0.2702 0.3021 -1.1123 C 0 0 0 0 0 0 0 0 0 0 0 0
  20414. -1.2785 0.0411 -0.1905 C 0 0 0 0 0 0 0 0 0 0 0 0
  20415. -0.9129 -0.3088 1.0996 C 0 0 0 0 0 0 0 0 0 0 0 0
  20416. 0.3682 -0.4117 1.5158 N 0 0 0 0 0 0 0 0 0 0 0 0
  20417. 1.3253 -0.1524 0.5985 C 0 0 0 0 0 0 0 0 0 0 0 0
  20418. 1.0589 0.2044 -0.7138 C 0 0 0 0 0 0 0 0 0 0 0 0
  20419. -0.5180 0.5793 -2.1328 H 0 0 0 0 0 0 0 0 0 0 0 0
  20420. -2.3238 0.1085 -0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0
  20421. -1.6631 -0.5221 1.8555 H 0 0 0 0 0 0 0 0 0 0 0 0
  20422. 2.3464 -0.2419 0.9577 H 0 0 0 0 0 0 0 0 0 0 0 0
  20423. 1.8678 0.4014 -1.4081 H 0 0 0 0 0 0 0 0 0 0 0 0
  20424. 1 2 2 0
  20425. 2 3 1 0
  20426. 3 4 2 0
  20427. 4 5 1 0
  20428. 5 6 2 0
  20429. 6 1 1 0
  20430. 1 7 1 0
  20431. 2 8 1 0
  20432. 3 9 1 0
  20433. 5 10 1 0
  20434. 6 11 1 0
  20435. M END
  20436. $$$$
  20437. RDKit 3D
  20438. 11 11 0 0 0 0 0 0 0 0999 V2000
  20439. -0.2702 0.3091 -1.1104 C 0 0 0 0 0 0 0 0 0 0 0 0
  20440. -1.2785 0.0423 -0.1902 C 0 0 0 0 0 0 0 0 0 0 0 0
  20441. -0.9129 -0.3157 1.0977 C 0 0 0 0 0 0 0 0 0 0 0 0
  20442. 0.3682 -0.4212 1.5132 N 0 0 0 0 0 0 0 0 0 0 0 0
  20443. 1.3253 -0.1562 0.5975 C 0 0 0 0 0 0 0 0 0 0 0 0
  20444. 1.0589 0.2089 -0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0
  20445. -0.5180 0.5926 -2.1292 H 0 0 0 0 0 0 0 0 0 0 0 0
  20446. -2.3238 0.1115 -0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0
  20447. -1.6631 -0.5337 1.8522 H 0 0 0 0 0 0 0 0 0 0 0 0
  20448. 2.3464 -0.2480 0.9562 H 0 0 0 0 0 0 0 0 0 0 0 0
  20449. 1.8678 0.4102 -1.4055 H 0 0 0 0 0 0 0 0 0 0 0 0
  20450. 1 2 2 0
  20451. 2 3 1 0
  20452. 3 4 2 0
  20453. 4 5 1 0
  20454. 5 6 2 0
  20455. 6 1 1 0
  20456. 1 7 1 0
  20457. 2 8 1 0
  20458. 3 9 1 0
  20459. 5 10 1 0
  20460. 6 11 1 0
  20461. M END
  20462. $$$$
  20463. RDKit 3D
  20464. 11 11 0 0 0 0 0 0 0 0999 V2000
  20465. -0.2702 0.3161 -1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0
  20466. -1.2785 0.0435 -0.1899 C 0 0 0 0 0 0 0 0 0 0 0 0
  20467. -0.9129 -0.3226 1.0957 C 0 0 0 0 0 0 0 0 0 0 0 0
  20468. 0.3682 -0.4307 1.5105 N 0 0 0 0 0 0 0 0 0 0 0 0
  20469. 1.3253 -0.1599 0.5965 C 0 0 0 0 0 0 0 0 0 0 0 0
  20470. 1.0589 0.2134 -0.7112 C 0 0 0 0 0 0 0 0 0 0 0 0
  20471. -0.5180 0.6060 -2.1254 H 0 0 0 0 0 0 0 0 0 0 0 0
  20472. -2.3238 0.1144 -0.4681 H 0 0 0 0 0 0 0 0 0 0 0 0
  20473. -1.6631 -0.5454 1.8488 H 0 0 0 0 0 0 0 0 0 0 0 0
  20474. 2.3464 -0.2540 0.9546 H 0 0 0 0 0 0 0 0 0 0 0 0
  20475. 1.8678 0.4190 -1.4029 H 0 0 0 0 0 0 0 0 0 0 0 0
  20476. 1 2 2 0
  20477. 2 3 1 0
  20478. 3 4 2 0
  20479. 4 5 1 0
  20480. 5 6 2 0
  20481. 6 1 1 0
  20482. 1 7 1 0
  20483. 2 8 1 0
  20484. 3 9 1 0
  20485. 5 10 1 0
  20486. 6 11 1 0
  20487. M END
  20488. $$$$
  20489. RDKit 3D
  20490. 11 11 0 0 0 0 0 0 0 0999 V2000
  20491. -0.2702 0.3230 -1.1065 C 0 0 0 0 0 0 0 0 0 0 0 0
  20492. -1.2785 0.0447 -0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0
  20493. -0.9129 -0.3294 1.0936 C 0 0 0 0 0 0 0 0 0 0 0 0
  20494. 0.3682 -0.4402 1.5078 N 0 0 0 0 0 0 0 0 0 0 0 0
  20495. 1.3253 -0.1637 0.5955 C 0 0 0 0 0 0 0 0 0 0 0 0
  20496. 1.0589 0.2179 -0.7099 C 0 0 0 0 0 0 0 0 0 0 0 0
  20497. -0.5180 0.6193 -2.1216 H 0 0 0 0 0 0 0 0 0 0 0 0
  20498. -2.3238 0.1174 -0.4674 H 0 0 0 0 0 0 0 0 0 0 0 0
  20499. -1.6631 -0.5570 1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0
  20500. 2.3464 -0.2600 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  20501. 1.8678 0.4279 -1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
  20502. 1 2 2 0
  20503. 2 3 1 0
  20504. 3 4 2 0
  20505. 4 5 1 0
  20506. 5 6 2 0
  20507. 6 1 1 0
  20508. 1 7 1 0
  20509. 2 8 1 0
  20510. 3 9 1 0
  20511. 5 10 1 0
  20512. 6 11 1 0
  20513. M END
  20514. $$$$
  20515. RDKit 3D
  20516. 11 11 0 0 0 0 0 0 0 0999 V2000
  20517. -0.2702 0.3300 -1.1044 C 0 0 0 0 0 0 0 0 0 0 0 0
  20518. -1.2785 0.0459 -0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0
  20519. -0.9129 -0.3363 1.0915 C 0 0 0 0 0 0 0 0 0 0 0 0
  20520. 0.3682 -0.4496 1.5050 N 0 0 0 0 0 0 0 0 0 0 0 0
  20521. 1.3253 -0.1674 0.5944 C 0 0 0 0 0 0 0 0 0 0 0 0
  20522. 1.0589 0.2223 -0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0
  20523. -0.5180 0.6327 -2.1176 H 0 0 0 0 0 0 0 0 0 0 0 0
  20524. -2.3238 0.1203 -0.4666 H 0 0 0 0 0 0 0 0 0 0 0 0
  20525. -1.6631 -0.5685 1.8418 H 0 0 0 0 0 0 0 0 0 0 0 0
  20526. 2.3464 -0.2659 0.9513 H 0 0 0 0 0 0 0 0 0 0 0 0
  20527. 1.8678 0.4366 -1.3975 H 0 0 0 0 0 0 0 0 0 0 0 0
  20528. 1 2 2 0
  20529. 2 3 1 0
  20530. 3 4 2 0
  20531. 4 5 1 0
  20532. 5 6 2 0
  20533. 6 1 1 0
  20534. 1 7 1 0
  20535. 2 8 1 0
  20536. 3 9 1 0
  20537. 5 10 1 0
  20538. 6 11 1 0
  20539. M END
  20540. $$$$
  20541. RDKit 3D
  20542. 11 11 0 0 0 0 0 0 0 0999 V2000
  20543. -0.2702 0.3369 -1.1023 C 0 0 0 0 0 0 0 0 0 0 0 0
  20544. -1.2785 0.0471 -0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0
  20545. -0.9129 -0.3432 1.0894 C 0 0 0 0 0 0 0 0 0 0 0 0
  20546. 0.3682 -0.4591 1.5021 N 0 0 0 0 0 0 0 0 0 0 0 0
  20547. 1.3253 -0.1711 0.5934 C 0 0 0 0 0 0 0 0 0 0 0 0
  20548. 1.0589 0.2268 -0.7071 C 0 0 0 0 0 0 0 0 0 0 0 0
  20549. -0.5180 0.6460 -2.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
  20550. -2.3238 0.1232 -0.4659 H 0 0 0 0 0 0 0 0 0 0 0 0
  20551. -1.6631 -0.5801 1.8382 H 0 0 0 0 0 0 0 0 0 0 0 0
  20552. 2.3464 -0.2719 0.9496 H 0 0 0 0 0 0 0 0 0 0 0 0
  20553. 1.8678 0.4454 -1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0
  20554. 1 2 2 0
  20555. 2 3 1 0
  20556. 3 4 2 0
  20557. 4 5 1 0
  20558. 5 6 2 0
  20559. 6 1 1 0
  20560. 1 7 1 0
  20561. 2 8 1 0
  20562. 3 9 1 0
  20563. 5 10 1 0
  20564. 6 11 1 0
  20565. M END
  20566. $$$$
  20567. RDKit 3D
  20568. 11 11 0 0 0 0 0 0 0 0999 V2000
  20569. -0.2702 0.3438 -1.1002 C 0 0 0 0 0 0 0 0 0 0 0 0
  20570. -1.2785 0.0483 -0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0
  20571. -0.9129 -0.3500 1.0872 C 0 0 0 0 0 0 0 0 0 0 0 0
  20572. 0.3682 -0.4685 1.4992 N 0 0 0 0 0 0 0 0 0 0 0 0
  20573. 1.3253 -0.1748 0.5923 C 0 0 0 0 0 0 0 0 0 0 0 0
  20574. 1.0589 0.2312 -0.7056 C 0 0 0 0 0 0 0 0 0 0 0 0
  20575. -0.5180 0.6592 -2.1095 H 0 0 0 0 0 0 0 0 0 0 0 0
  20576. -2.3238 0.1262 -0.4651 H 0 0 0 0 0 0 0 0 0 0 0 0
  20577. -1.6631 -0.5916 1.8345 H 0 0 0 0 0 0 0 0 0 0 0 0
  20578. 2.3464 -0.2779 0.9479 H 0 0 0 0 0 0 0 0 0 0 0 0
  20579. 1.8678 0.4542 -1.3919 H 0 0 0 0 0 0 0 0 0 0 0 0
  20580. 1 2 2 0
  20581. 2 3 1 0
  20582. 3 4 2 0
  20583. 4 5 1 0
  20584. 5 6 2 0
  20585. 6 1 1 0
  20586. 1 7 1 0
  20587. 2 8 1 0
  20588. 3 9 1 0
  20589. 5 10 1 0
  20590. 6 11 1 0
  20591. M END
  20592. $$$$
  20593. RDKit 3D
  20594. 11 11 0 0 0 0 0 0 0 0999 V2000
  20595. -0.2702 0.3507 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  20596. -1.2785 0.0495 -0.1885 C 0 0 0 0 0 0 0 0 0 0 0 0
  20597. -0.9129 -0.3568 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  20598. 0.3682 -0.4779 1.4963 N 0 0 0 0 0 0 0 0 0 0 0 0
  20599. 1.3253 -0.1786 0.5912 C 0 0 0 0 0 0 0 0 0 0 0 0
  20600. 1.0589 0.2356 -0.7042 C 0 0 0 0 0 0 0 0 0 0 0 0
  20601. -0.5180 0.6725 -2.1053 H 0 0 0 0 0 0 0 0 0 0 0 0
  20602. -2.3238 0.1291 -0.4643 H 0 0 0 0 0 0 0 0 0 0 0 0
  20603. -1.6631 -0.6032 1.8307 H 0 0 0 0 0 0 0 0 0 0 0 0
  20604. 2.3464 -0.2838 0.9461 H 0 0 0 0 0 0 0 0 0 0 0 0
  20605. 1.8678 0.4629 -1.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
  20606. 1 2 2 0
  20607. 2 3 1 0
  20608. 3 4 2 0
  20609. 4 5 1 0
  20610. 5 6 2 0
  20611. 6 1 1 0
  20612. 1 7 1 0
  20613. 2 8 1 0
  20614. 3 9 1 0
  20615. 5 10 1 0
  20616. 6 11 1 0
  20617. M END
  20618. $$$$
  20619. RDKit 3D
  20620. 11 11 0 0 0 0 0 0 0 0999 V2000
  20621. -0.2702 0.3576 -1.0958 C 0 0 0 0 0 0 0 0 0 0 0 0
  20622. -1.2785 0.0507 -0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0
  20623. -0.9129 -0.3636 1.0827 C 0 0 0 0 0 0 0 0 0 0 0 0
  20624. 0.3682 -0.4873 1.4932 N 0 0 0 0 0 0 0 0 0 0 0 0
  20625. 1.3253 -0.1823 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0
  20626. 1.0589 0.2401 -0.7027 C 0 0 0 0 0 0 0 0 0 0 0 0
  20627. -0.5180 0.6857 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  20628. -2.3238 0.1320 -0.4635 H 0 0 0 0 0 0 0 0 0 0 0 0
  20629. -1.6631 -0.6146 1.8269 H 0 0 0 0 0 0 0 0 0 0 0 0
  20630. 2.3464 -0.2898 0.9443 H 0 0 0 0 0 0 0 0 0 0 0 0
  20631. 1.8678 0.4716 -1.3861 H 0 0 0 0 0 0 0 0 0 0 0 0
  20632. 1 2 2 0
  20633. 2 3 1 0
  20634. 3 4 2 0
  20635. 4 5 1 0
  20636. 5 6 2 0
  20637. 6 1 1 0
  20638. 1 7 1 0
  20639. 2 8 1 0
  20640. 3 9 1 0
  20641. 5 10 1 0
  20642. 6 11 1 0
  20643. M END
  20644. $$$$
  20645. RDKit 3D
  20646. 11 11 0 0 0 0 0 0 0 0999 V2000
  20647. -0.2702 0.3645 -1.0935 C 0 0 0 0 0 0 0 0 0 0 0 0
  20648. -1.2785 0.0518 -0.1878 C 0 0 0 0 0 0 0 0 0 0 0 0
  20649. -0.9129 -0.3704 1.0804 C 0 0 0 0 0 0 0 0 0 0 0 0
  20650. 0.3682 -0.4967 1.4901 N 0 0 0 0 0 0 0 0 0 0 0 0
  20651. 1.3253 -0.1860 0.5889 C 0 0 0 0 0 0 0 0 0 0 0 0
  20652. 1.0589 0.2445 -0.7011 C 0 0 0 0 0 0 0 0 0 0 0 0
  20653. -0.5180 0.6989 -2.0967 H 0 0 0 0 0 0 0 0 0 0 0 0
  20654. -2.3238 0.1349 -0.4626 H 0 0 0 0 0 0 0 0 0 0 0 0
  20655. -1.6631 -0.6261 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0
  20656. 2.3464 -0.2957 0.9425 H 0 0 0 0 0 0 0 0 0 0 0 0
  20657. 1.8678 0.4803 -1.3831 H 0 0 0 0 0 0 0 0 0 0 0 0
  20658. 1 2 2 0
  20659. 2 3 1 0
  20660. 3 4 2 0
  20661. 4 5 1 0
  20662. 5 6 2 0
  20663. 6 1 1 0
  20664. 1 7 1 0
  20665. 2 8 1 0
  20666. 3 9 1 0
  20667. 5 10 1 0
  20668. 6 11 1 0
  20669. M END
  20670. $$$$
  20671. RDKit 3D
  20672. 11 11 0 0 0 0 0 0 0 0999 V2000
  20673. -0.2702 0.3713 -1.0912 C 0 0 0 0 0 0 0 0 0 0 0 0
  20674. -1.2785 0.0530 -0.1875 C 0 0 0 0 0 0 0 0 0 0 0 0
  20675. -0.9129 -0.3772 1.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
  20676. 0.3682 -0.5060 1.4870 N 0 0 0 0 0 0 0 0 0 0 0 0
  20677. 1.3253 -0.1897 0.5877 C 0 0 0 0 0 0 0 0 0 0 0 0
  20678. 1.0589 0.2489 -0.6996 C 0 0 0 0 0 0 0 0 0 0 0 0
  20679. -0.5180 0.7120 -2.0923 H 0 0 0 0 0 0 0 0 0 0 0 0
  20680. -2.3238 0.1378 -0.4618 H 0 0 0 0 0 0 0 0 0 0 0 0
  20681. -1.6631 -0.6376 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
  20682. 2.3464 -0.3016 0.9406 H 0 0 0 0 0 0 0 0 0 0 0 0
  20683. 1.8678 0.4890 -1.3801 H 0 0 0 0 0 0 0 0 0 0 0 0
  20684. 1 2 2 0
  20685. 2 3 1 0
  20686. 3 4 2 0
  20687. 4 5 1 0
  20688. 5 6 2 0
  20689. 6 1 1 0
  20690. 1 7 1 0
  20691. 2 8 1 0
  20692. 3 9 1 0
  20693. 5 10 1 0
  20694. 6 11 1 0
  20695. M END
  20696. $$$$
  20697. RDKit 3D
  20698. 11 11 0 0 0 0 0 0 0 0999 V2000
  20699. -0.2702 0.3782 -1.0888 C 0 0 0 0 0 0 0 0 0 0 0 0
  20700. -1.2785 0.0542 -0.1872 C 0 0 0 0 0 0 0 0 0 0 0 0
  20701. -0.9129 -0.3840 1.0757 C 0 0 0 0 0 0 0 0 0 0 0 0
  20702. 0.3682 -0.5154 1.4838 N 0 0 0 0 0 0 0 0 0 0 0 0
  20703. 1.3253 -0.1934 0.5865 C 0 0 0 0 0 0 0 0 0 0 0 0
  20704. 1.0589 0.2533 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0
  20705. -0.5180 0.7252 -2.0878 H 0 0 0 0 0 0 0 0 0 0 0 0
  20706. -2.3238 0.1407 -0.4609 H 0 0 0 0 0 0 0 0 0 0 0 0
  20707. -1.6631 -0.6490 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0
  20708. 2.3464 -0.3075 0.9387 H 0 0 0 0 0 0 0 0 0 0 0 0
  20709. 1.8678 0.4977 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0
  20710. 1 2 2 0
  20711. 2 3 1 0
  20712. 3 4 2 0
  20713. 4 5 1 0
  20714. 5 6 2 0
  20715. 6 1 1 0
  20716. 1 7 1 0
  20717. 2 8 1 0
  20718. 3 9 1 0
  20719. 5 10 1 0
  20720. 6 11 1 0
  20721. M END
  20722. $$$$
  20723. RDKit 3D
  20724. 11 11 0 0 0 0 0 0 0 0999 V2000
  20725. -0.2702 0.3850 -1.0864 C 0 0 0 0 0 0 0 0 0 0 0 0
  20726. -1.2785 0.0554 -0.1868 C 0 0 0 0 0 0 0 0 0 0 0 0
  20727. -0.9129 -0.3907 1.0732 C 0 0 0 0 0 0 0 0 0 0 0 0
  20728. 0.3682 -0.5247 1.4805 N 0 0 0 0 0 0 0 0 0 0 0 0
  20729. 1.3253 -0.1970 0.5853 C 0 0 0 0 0 0 0 0 0 0 0 0
  20730. 1.0589 0.2576 -0.6964 C 0 0 0 0 0 0 0 0 0 0 0 0
  20731. -0.5180 0.7383 -2.0832 H 0 0 0 0 0 0 0 0 0 0 0 0
  20732. -2.3238 0.1436 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0
  20733. -1.6631 -0.6604 1.8109 H 0 0 0 0 0 0 0 0 0 0 0 0
  20734. 2.3464 -0.3134 0.9368 H 0 0 0 0 0 0 0 0 0 0 0 0
  20735. 1.8678 0.5063 -1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0
  20736. 1 2 2 0
  20737. 2 3 1 0
  20738. 3 4 2 0
  20739. 4 5 1 0
  20740. 5 6 2 0
  20741. 6 1 1 0
  20742. 1 7 1 0
  20743. 2 8 1 0
  20744. 3 9 1 0
  20745. 5 10 1 0
  20746. 6 11 1 0
  20747. M END
  20748. $$$$
  20749. RDKit 3D
  20750. 11 11 0 0 0 0 0 0 0 0999 V2000
  20751. -0.2702 0.3918 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
  20752. -1.2785 0.0566 -0.1865 C 0 0 0 0 0 0 0 0 0 0 0 0
  20753. -0.9129 -0.3975 1.0708 C 0 0 0 0 0 0 0 0 0 0 0 0
  20754. 0.3682 -0.5340 1.4772 N 0 0 0 0 0 0 0 0 0 0 0 0
  20755. 1.3253 -0.2007 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0
  20756. 1.0589 0.2620 -0.6948 C 0 0 0 0 0 0 0 0 0 0 0 0
  20757. -0.5180 0.7513 -2.0785 H 0 0 0 0 0 0 0 0 0 0 0 0
  20758. -2.3238 0.1465 -0.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
  20759. -1.6631 -0.6717 1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0
  20760. 2.3464 -0.3193 0.9348 H 0 0 0 0 0 0 0 0 0 0 0 0
  20761. 1.8678 0.5149 -1.3706 H 0 0 0 0 0 0 0 0 0 0 0 0
  20762. 1 2 2 0
  20763. 2 3 1 0
  20764. 3 4 2 0
  20765. 4 5 1 0
  20766. 5 6 2 0
  20767. 6 1 1 0
  20768. 1 7 1 0
  20769. 2 8 1 0
  20770. 3 9 1 0
  20771. 5 10 1 0
  20772. 6 11 1 0
  20773. M END
  20774. $$$$
  20775. RDKit 3D
  20776. 11 11 0 0 0 0 0 0 0 0999 V2000
  20777. -0.2702 0.3987 -1.0815 C 0 0 0 0 0 0 0 0 0 0 0 0
  20778. -1.2785 0.0577 -0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0
  20779. -0.9129 -0.4042 1.0682 C 0 0 0 0 0 0 0 0 0 0 0 0
  20780. 0.3682 -0.5433 1.4738 N 0 0 0 0 0 0 0 0 0 0 0 0
  20781. 1.3253 -0.2044 0.5828 C 0 0 0 0 0 0 0 0 0 0 0 0
  20782. 1.0589 0.2664 -0.6931 C 0 0 0 0 0 0 0 0 0 0 0 0
  20783. -0.5180 0.7644 -2.0737 H 0 0 0 0 0 0 0 0 0 0 0 0
  20784. -2.3238 0.1494 -0.4582 H 0 0 0 0 0 0 0 0 0 0 0 0
  20785. -1.6631 -0.6831 1.8024 H 0 0 0 0 0 0 0 0 0 0 0 0
  20786. 2.3464 -0.3251 0.9327 H 0 0 0 0 0 0 0 0 0 0 0 0
  20787. 1.8678 0.5235 -1.3674 H 0 0 0 0 0 0 0 0 0 0 0 0
  20788. 1 2 2 0
  20789. 2 3 1 0
  20790. 3 4 2 0
  20791. 4 5 1 0
  20792. 5 6 2 0
  20793. 6 1 1 0
  20794. 1 7 1 0
  20795. 2 8 1 0
  20796. 3 9 1 0
  20797. 5 10 1 0
  20798. 6 11 1 0
  20799. M END
  20800. $$$$
  20801. RDKit 3D
  20802. 11 11 0 0 0 0 0 0 0 0999 V2000
  20803. -0.2702 0.4054 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
  20804. -1.2785 0.0589 -0.1857 C 0 0 0 0 0 0 0 0 0 0 0 0
  20805. -0.9129 -0.4109 1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0
  20806. 0.3682 -0.5525 1.4703 N 0 0 0 0 0 0 0 0 0 0 0 0
  20807. 1.3253 -0.2080 0.5815 C 0 0 0 0 0 0 0 0 0 0 0 0
  20808. 1.0589 0.2707 -0.6914 C 0 0 0 0 0 0 0 0 0 0 0 0
  20809. -0.5180 0.7774 -2.0689 H 0 0 0 0 0 0 0 0 0 0 0 0
  20810. -2.3238 0.1522 -0.4572 H 0 0 0 0 0 0 0 0 0 0 0 0
  20811. -1.6631 -0.6944 1.7981 H 0 0 0 0 0 0 0 0 0 0 0 0
  20812. 2.3464 -0.3310 0.9307 H 0 0 0 0 0 0 0 0 0 0 0 0
  20813. 1.8678 0.5321 -1.3641 H 0 0 0 0 0 0 0 0 0 0 0 0
  20814. 1 2 2 0
  20815. 2 3 1 0
  20816. 3 4 2 0
  20817. 4 5 1 0
  20818. 5 6 2 0
  20819. 6 1 1 0
  20820. 1 7 1 0
  20821. 2 8 1 0
  20822. 3 9 1 0
  20823. 5 10 1 0
  20824. 6 11 1 0
  20825. M END
  20826. $$$$
  20827. RDKit 3D
  20828. 11 11 0 0 0 0 0 0 0 0999 V2000
  20829. -0.2702 0.4122 -1.0764 C 0 0 0 0 0 0 0 0 0 0 0 0
  20830. -1.2785 0.0601 -0.1854 C 0 0 0 0 0 0 0 0 0 0 0 0
  20831. -0.9129 -0.4176 1.0631 C 0 0 0 0 0 0 0 0 0 0 0 0
  20832. 0.3682 -0.5617 1.4668 N 0 0 0 0 0 0 0 0 0 0 0 0
  20833. 1.3253 -0.2117 0.5801 C 0 0 0 0 0 0 0 0 0 0 0 0
  20834. 1.0589 0.2751 -0.6897 C 0 0 0 0 0 0 0 0 0 0 0 0
  20835. -0.5180 0.7904 -2.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
  20836. -2.3238 0.1551 -0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0
  20837. -1.6631 -0.7057 1.7937 H 0 0 0 0 0 0 0 0 0 0 0 0
  20838. 2.3464 -0.3368 0.9286 H 0 0 0 0 0 0 0 0 0 0 0 0
  20839. 1.8678 0.5407 -1.3607 H 0 0 0 0 0 0 0 0 0 0 0 0
  20840. 1 2 2 0
  20841. 2 3 1 0
  20842. 3 4 2 0
  20843. 4 5 1 0
  20844. 5 6 2 0
  20845. 6 1 1 0
  20846. 1 7 1 0
  20847. 2 8 1 0
  20848. 3 9 1 0
  20849. 5 10 1 0
  20850. 6 11 1 0
  20851. M END
  20852. $$$$
  20853. RDKit 3D
  20854. 11 11 0 0 0 0 0 0 0 0999 V2000
  20855. -0.2702 0.4190 -1.0738 C 0 0 0 0 0 0 0 0 0 0 0 0
  20856. -1.2785 0.0612 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
  20857. -0.9129 -0.4242 1.0604 C 0 0 0 0 0 0 0 0 0 0 0 0
  20858. 0.3682 -0.5709 1.4633 N 0 0 0 0 0 0 0 0 0 0 0 0
  20859. 1.3253 -0.2153 0.5788 C 0 0 0 0 0 0 0 0 0 0 0 0
  20860. 1.0589 0.2794 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
  20861. -0.5180 0.8033 -2.0589 H 0 0 0 0 0 0 0 0 0 0 0 0
  20862. -2.3238 0.1580 -0.4553 H 0 0 0 0 0 0 0 0 0 0 0 0
  20863. -1.6631 -0.7169 1.7893 H 0 0 0 0 0 0 0 0 0 0 0 0
  20864. 2.3464 -0.3427 0.9264 H 0 0 0 0 0 0 0 0 0 0 0 0
  20865. 1.8678 0.5492 -1.3573 H 0 0 0 0 0 0 0 0 0 0 0 0
  20866. 1 2 2 0
  20867. 2 3 1 0
  20868. 3 4 2 0
  20869. 4 5 1 0
  20870. 5 6 2 0
  20871. 6 1 1 0
  20872. 1 7 1 0
  20873. 2 8 1 0
  20874. 3 9 1 0
  20875. 5 10 1 0
  20876. 6 11 1 0
  20877. M END
  20878. $$$$
  20879. RDKit 3D
  20880. 11 11 0 0 0 0 0 0 0 0999 V2000
  20881. -0.2702 0.4257 -1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0
  20882. -1.2785 0.0624 -0.1846 C 0 0 0 0 0 0 0 0 0 0 0 0
  20883. -0.9129 -0.4309 1.0578 C 0 0 0 0 0 0 0 0 0 0 0 0
  20884. 0.3682 -0.5801 1.4597 N 0 0 0 0 0 0 0 0 0 0 0 0
  20885. 1.3253 -0.2190 0.5774 C 0 0 0 0 0 0 0 0 0 0 0 0
  20886. 1.0589 0.2837 -0.6862 C 0 0 0 0 0 0 0 0 0 0 0 0
  20887. -0.5180 0.8163 -2.0538 H 0 0 0 0 0 0 0 0 0 0 0 0
  20888. -2.3238 0.1608 -0.4543 H 0 0 0 0 0 0 0 0 0 0 0 0
  20889. -1.6631 -0.7281 1.7847 H 0 0 0 0 0 0 0 0 0 0 0 0
  20890. 2.3464 -0.3485 0.9243 H 0 0 0 0 0 0 0 0 0 0 0 0
  20891. 1.8678 0.5577 -1.3538 H 0 0 0 0 0 0 0 0 0 0 0 0
  20892. 1 2 2 0
  20893. 2 3 1 0
  20894. 3 4 2 0
  20895. 4 5 1 0
  20896. 5 6 2 0
  20897. 6 1 1 0
  20898. 1 7 1 0
  20899. 2 8 1 0
  20900. 3 9 1 0
  20901. 5 10 1 0
  20902. 6 11 1 0
  20903. M END
  20904. $$$$
  20905. RDKit 3D
  20906. 11 11 0 0 0 0 0 0 0 0999 V2000
  20907. -0.2702 0.4324 -1.0685 C 0 0 0 0 0 0 0 0 0 0 0 0
  20908. -1.2785 0.0635 -0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0
  20909. -0.9129 -0.4375 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
  20910. 0.3682 -0.5893 1.4560 N 0 0 0 0 0 0 0 0 0 0 0 0
  20911. 1.3253 -0.2226 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0
  20912. 1.0589 0.2880 -0.6844 C 0 0 0 0 0 0 0 0 0 0 0 0
  20913. -0.5180 0.8291 -2.0487 H 0 0 0 0 0 0 0 0 0 0 0 0
  20914. -2.3238 0.1637 -0.4532 H 0 0 0 0 0 0 0 0 0 0 0 0
  20915. -1.6631 -0.7393 1.7801 H 0 0 0 0 0 0 0 0 0 0 0 0
  20916. 2.3464 -0.3543 0.9221 H 0 0 0 0 0 0 0 0 0 0 0 0
  20917. 1.8678 0.5662 -1.3502 H 0 0 0 0 0 0 0 0 0 0 0 0
  20918. 1 2 2 0
  20919. 2 3 1 0
  20920. 3 4 2 0
  20921. 4 5 1 0
  20922. 5 6 2 0
  20923. 6 1 1 0
  20924. 1 7 1 0
  20925. 2 8 1 0
  20926. 3 9 1 0
  20927. 5 10 1 0
  20928. 6 11 1 0
  20929. M END
  20930. $$$$
  20931. RDKit 3D
  20932. 11 11 0 0 0 0 0 0 0 0999 V2000
  20933. -0.2702 0.4391 -1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0
  20934. -1.2785 0.0647 -0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0
  20935. -0.9129 -0.4442 1.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
  20936. 0.3682 -0.5984 1.4523 N 0 0 0 0 0 0 0 0 0 0 0 0
  20937. 1.3253 -0.2262 0.5746 C 0 0 0 0 0 0 0 0 0 0 0 0
  20938. 1.0589 0.2923 -0.6826 C 0 0 0 0 0 0 0 0 0 0 0 0
  20939. -0.5180 0.8420 -2.0434 H 0 0 0 0 0 0 0 0 0 0 0 0
  20940. -2.3238 0.1665 -0.4522 H 0 0 0 0 0 0 0 0 0 0 0 0
  20941. -1.6631 -0.7505 1.7754 H 0 0 0 0 0 0 0 0 0 0 0 0
  20942. 2.3464 -0.3601 0.9198 H 0 0 0 0 0 0 0 0 0 0 0 0
  20943. 1.8678 0.5747 -1.3467 H 0 0 0 0 0 0 0 0 0 0 0 0
  20944. 1 2 2 0
  20945. 2 3 1 0
  20946. 3 4 2 0
  20947. 4 5 1 0
  20948. 5 6 2 0
  20949. 6 1 1 0
  20950. 1 7 1 0
  20951. 2 8 1 0
  20952. 3 9 1 0
  20953. 5 10 1 0
  20954. 6 11 1 0
  20955. M END
  20956. $$$$
  20957. RDKit 3D
  20958. 11 11 0 0 0 0 0 0 0 0999 V2000
  20959. -0.2702 0.4458 -1.0629 C 0 0 0 0 0 0 0 0 0 0 0 0
  20960. -1.2785 0.0658 -0.1834 C 0 0 0 0 0 0 0 0 0 0 0 0
  20961. -0.9129 -0.4508 1.0494 C 0 0 0 0 0 0 0 0 0 0 0 0
  20962. 0.3682 -0.6075 1.4485 N 0 0 0 0 0 0 0 0 0 0 0 0
  20963. 1.3253 -0.2298 0.5732 C 0 0 0 0 0 0 0 0 0 0 0 0
  20964. 1.0589 0.2966 -0.6807 C 0 0 0 0 0 0 0 0 0 0 0 0
  20965. -0.5180 0.8548 -2.0381 H 0 0 0 0 0 0 0 0 0 0 0 0
  20966. -2.3238 0.1694 -0.4512 H 0 0 0 0 0 0 0 0 0 0 0 0
  20967. -1.6631 -0.7617 1.7707 H 0 0 0 0 0 0 0 0 0 0 0 0
  20968. 2.3464 -0.3658 0.9175 H 0 0 0 0 0 0 0 0 0 0 0 0
  20969. 1.8678 0.5831 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0
  20970. 1 2 2 0
  20971. 2 3 1 0
  20972. 3 4 2 0
  20973. 4 5 1 0
  20974. 5 6 2 0
  20975. 6 1 1 0
  20976. 1 7 1 0
  20977. 2 8 1 0
  20978. 3 9 1 0
  20979. 5 10 1 0
  20980. 6 11 1 0
  20981. M END
  20982. $$$$
  20983. RDKit 3D
  20984. 11 11 0 0 0 0 0 0 0 0999 V2000
  20985. -0.2702 0.4525 -1.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
  20986. -1.2785 0.0670 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0
  20987. -0.9129 -0.4573 1.0466 C 0 0 0 0 0 0 0 0 0 0 0 0
  20988. 0.3682 -0.6166 1.4446 N 0 0 0 0 0 0 0 0 0 0 0 0
  20989. 1.3253 -0.2334 0.5718 C 0 0 0 0 0 0 0 0 0 0 0 0
  20990. 1.0589 0.3009 -0.6789 C 0 0 0 0 0 0 0 0 0 0 0 0
  20991. -0.5180 0.8676 -2.0327 H 0 0 0 0 0 0 0 0 0 0 0 0
  20992. -2.3238 0.1722 -0.4501 H 0 0 0 0 0 0 0 0 0 0 0 0
  20993. -1.6631 -0.7728 1.7659 H 0 0 0 0 0 0 0 0 0 0 0 0
  20994. 2.3464 -0.3716 0.9152 H 0 0 0 0 0 0 0 0 0 0 0 0
  20995. 1.8678 0.5916 -1.3393 H 0 0 0 0 0 0 0 0 0 0 0 0
  20996. 1 2 2 0
  20997. 2 3 1 0
  20998. 3 4 2 0
  20999. 4 5 1 0
  21000. 5 6 2 0
  21001. 6 1 1 0
  21002. 1 7 1 0
  21003. 2 8 1 0
  21004. 3 9 1 0
  21005. 5 10 1 0
  21006. 6 11 1 0
  21007. M END
  21008. $$$$
  21009. RDKit 3D
  21010. 11 11 0 0 0 0 0 0 0 0999 V2000
  21011. -0.2702 0.4591 -1.0572 C 0 0 0 0 0 0 0 0 0 0 0 0
  21012. -1.2785 0.0681 -0.1825 C 0 0 0 0 0 0 0 0 0 0 0 0
  21013. -0.9129 -0.4639 1.0437 C 0 0 0 0 0 0 0 0 0 0 0 0
  21014. 0.3682 -0.6257 1.4407 N 0 0 0 0 0 0 0 0 0 0 0 0
  21015. 1.3253 -0.2370 0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0
  21016. 1.0589 0.3051 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0
  21017. -0.5180 0.8804 -2.0272 H 0 0 0 0 0 0 0 0 0 0 0 0
  21018. -2.3238 0.1750 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
  21019. -1.6631 -0.7838 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0
  21020. 2.3464 -0.3773 0.9129 H 0 0 0 0 0 0 0 0 0 0 0 0
  21021. 1.8678 0.6000 -1.3356 H 0 0 0 0 0 0 0 0 0 0 0 0
  21022. 1 2 2 0
  21023. 2 3 1 0
  21024. 3 4 2 0
  21025. 4 5 1 0
  21026. 5 6 2 0
  21027. 6 1 1 0
  21028. 1 7 1 0
  21029. 2 8 1 0
  21030. 3 9 1 0
  21031. 5 10 1 0
  21032. 6 11 1 0
  21033. M END
  21034. $$$$
  21035. RDKit 3D
  21036. 11 11 0 0 0 0 0 0 0 0999 V2000
  21037. -0.2702 0.4658 -1.0543 C 0 0 0 0 0 0 0 0 0 0 0 0
  21038. -1.2785 0.0693 -0.1821 C 0 0 0 0 0 0 0 0 0 0 0 0
  21039. -0.9129 -0.4705 1.0408 C 0 0 0 0 0 0 0 0 0 0 0 0
  21040. 0.3682 -0.6347 1.4368 N 0 0 0 0 0 0 0 0 0 0 0 0
  21041. 1.3253 -0.2406 0.5688 C 0 0 0 0 0 0 0 0 0 0 0 0
  21042. 1.0589 0.3094 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0
  21043. -0.5180 0.8931 -2.0216 H 0 0 0 0 0 0 0 0 0 0 0 0
  21044. -2.3238 0.1778 -0.4479 H 0 0 0 0 0 0 0 0 0 0 0 0
  21045. -1.6631 -0.7949 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0
  21046. 2.3464 -0.3831 0.9105 H 0 0 0 0 0 0 0 0 0 0 0 0
  21047. 1.8678 0.6084 -1.3318 H 0 0 0 0 0 0 0 0 0 0 0 0
  21048. 1 2 2 0
  21049. 2 3 1 0
  21050. 3 4 2 0
  21051. 4 5 1 0
  21052. 5 6 2 0
  21053. 6 1 1 0
  21054. 1 7 1 0
  21055. 2 8 1 0
  21056. 3 9 1 0
  21057. 5 10 1 0
  21058. 6 11 1 0
  21059. M END
  21060. $$$$
  21061. RDKit 3D
  21062. 11 11 0 0 0 0 0 0 0 0999 V2000
  21063. -0.2702 0.4724 -1.0514 C 0 0 0 0 0 0 0 0 0 0 0 0
  21064. -1.2785 0.0704 -0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0
  21065. -0.9129 -0.4770 1.0378 C 0 0 0 0 0 0 0 0 0 0 0 0
  21066. 0.3682 -0.6437 1.4328 N 0 0 0 0 0 0 0 0 0 0 0 0
  21067. 1.3253 -0.2441 0.5673 C 0 0 0 0 0 0 0 0 0 0 0 0
  21068. 1.0589 0.3136 -0.6731 C 0 0 0 0 0 0 0 0 0 0 0 0
  21069. -0.5180 0.9058 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0
  21070. -2.3238 0.1807 -0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0
  21071. -1.6631 -0.8059 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0
  21072. 2.3464 -0.3888 0.9081 H 0 0 0 0 0 0 0 0 0 0 0 0
  21073. 1.8678 0.6167 -1.3279 H 0 0 0 0 0 0 0 0 0 0 0 0
  21074. 1 2 2 0
  21075. 2 3 1 0
  21076. 3 4 2 0
  21077. 4 5 1 0
  21078. 5 6 2 0
  21079. 6 1 1 0
  21080. 1 7 1 0
  21081. 2 8 1 0
  21082. 3 9 1 0
  21083. 5 10 1 0
  21084. 6 11 1 0
  21085. M END
  21086. $$$$
  21087. RDKit 3D
  21088. 11 11 0 0 0 0 0 0 0 0999 V2000
  21089. -0.2702 0.4790 -1.0484 C 0 0 0 0 0 0 0 0 0 0 0 0
  21090. -1.2785 0.0716 -0.1812 C 0 0 0 0 0 0 0 0 0 0 0 0
  21091. -0.9129 -0.4835 1.0348 C 0 0 0 0 0 0 0 0 0 0 0 0
  21092. 0.3682 -0.6527 1.4287 N 0 0 0 0 0 0 0 0 0 0 0 0
  21093. 1.3253 -0.2477 0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0
  21094. 1.0589 0.3178 -0.6711 C 0 0 0 0 0 0 0 0 0 0 0 0
  21095. -0.5180 0.9184 -2.0102 H 0 0 0 0 0 0 0 0 0 0 0 0
  21096. -2.3238 0.1835 -0.4456 H 0 0 0 0 0 0 0 0 0 0 0 0
  21097. -1.6631 -0.8169 1.7459 H 0 0 0 0 0 0 0 0 0 0 0 0
  21098. 2.3464 -0.3945 0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0
  21099. 1.8678 0.6250 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0
  21100. 1 2 2 0
  21101. 2 3 1 0
  21102. 3 4 2 0
  21103. 4 5 1 0
  21104. 5 6 2 0
  21105. 6 1 1 0
  21106. 1 7 1 0
  21107. 2 8 1 0
  21108. 3 9 1 0
  21109. 5 10 1 0
  21110. 6 11 1 0
  21111. M END
  21112. $$$$
  21113. RDKit 3D
  21114. 11 11 0 0 0 0 0 0 0 0999 V2000
  21115. -0.2702 0.4856 -1.0454 C 0 0 0 0 0 0 0 0 0 0 0 0
  21116. -1.2785 0.0727 -0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0
  21117. -0.9129 -0.4900 1.0317 C 0 0 0 0 0 0 0 0 0 0 0 0
  21118. 0.3682 -0.6617 1.4246 N 0 0 0 0 0 0 0 0 0 0 0 0
  21119. 1.3253 -0.2513 0.5641 C 0 0 0 0 0 0 0 0 0 0 0 0
  21120. 1.0589 0.3220 -0.6691 C 0 0 0 0 0 0 0 0 0 0 0 0
  21121. -0.5180 0.9310 -2.0044 H 0 0 0 0 0 0 0 0 0 0 0 0
  21122. -2.3238 0.1863 -0.4445 H 0 0 0 0 0 0 0 0 0 0 0 0
  21123. -1.6631 -0.8279 1.7407 H 0 0 0 0 0 0 0 0 0 0 0 0
  21124. 2.3464 -0.4002 0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0
  21125. 1.8678 0.6334 -1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0
  21126. 1 2 2 0
  21127. 2 3 1 0
  21128. 3 4 2 0
  21129. 4 5 1 0
  21130. 5 6 2 0
  21131. 6 1 1 0
  21132. 1 7 1 0
  21133. 2 8 1 0
  21134. 3 9 1 0
  21135. 5 10 1 0
  21136. 6 11 1 0
  21137. M END
  21138. $$$$
  21139. RDKit 3D
  21140. 11 11 0 0 0 0 0 0 0 0999 V2000
  21141. -0.2702 0.4921 -1.0423 C 0 0 0 0 0 0 0 0 0 0 0 0
  21142. -1.2785 0.0738 -0.1803 C 0 0 0 0 0 0 0 0 0 0 0 0
  21143. -0.9129 -0.4965 1.0286 C 0 0 0 0 0 0 0 0 0 0 0 0
  21144. 0.3682 -0.6706 1.4204 N 0 0 0 0 0 0 0 0 0 0 0 0
  21145. 1.3253 -0.2548 0.5625 C 0 0 0 0 0 0 0 0 0 0 0 0
  21146. 1.0589 0.3262 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0
  21147. -0.5180 0.9436 -1.9985 H 0 0 0 0 0 0 0 0 0 0 0 0
  21148. -2.3238 0.1890 -0.4433 H 0 0 0 0 0 0 0 0 0 0 0 0
  21149. -1.6631 -0.8388 1.7355 H 0 0 0 0 0 0 0 0 0 0 0 0
  21150. 2.3464 -0.4058 0.9006 H 0 0 0 0 0 0 0 0 0 0 0 0
  21151. 1.8678 0.6416 -1.3161 H 0 0 0 0 0 0 0 0 0 0 0 0
  21152. 1 2 2 0
  21153. 2 3 1 0
  21154. 3 4 2 0
  21155. 4 5 1 0
  21156. 5 6 2 0
  21157. 6 1 1 0
  21158. 1 7 1 0
  21159. 2 8 1 0
  21160. 3 9 1 0
  21161. 5 10 1 0
  21162. 6 11 1 0
  21163. M END
  21164. $$$$
  21165. RDKit 3D
  21166. 11 11 0 0 0 0 0 0 0 0999 V2000
  21167. -0.2702 0.4987 -1.0392 C 0 0 0 0 0 0 0 0 0 0 0 0
  21168. -1.2785 0.0750 -0.1798 C 0 0 0 0 0 0 0 0 0 0 0 0
  21169. -0.9129 -0.5029 1.0255 C 0 0 0 0 0 0 0 0 0 0 0 0
  21170. 0.3682 -0.6795 1.4161 N 0 0 0 0 0 0 0 0 0 0 0 0
  21171. 1.3253 -0.2583 0.5609 C 0 0 0 0 0 0 0 0 0 0 0 0
  21172. 1.0589 0.3304 -0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0
  21173. -0.5180 0.9561 -1.9926 H 0 0 0 0 0 0 0 0 0 0 0 0
  21174. -2.3238 0.1918 -0.4421 H 0 0 0 0 0 0 0 0 0 0 0 0
  21175. -1.6631 -0.8497 1.7302 H 0 0 0 0 0 0 0 0 0 0 0 0
  21176. 2.3464 -0.4115 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0
  21177. 1.8678 0.6499 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
  21178. 1 2 2 0
  21179. 2 3 1 0
  21180. 3 4 2 0
  21181. 4 5 1 0
  21182. 5 6 2 0
  21183. 6 1 1 0
  21184. 1 7 1 0
  21185. 2 8 1 0
  21186. 3 9 1 0
  21187. 5 10 1 0
  21188. 6 11 1 0
  21189. M END
  21190. $$$$
  21191. RDKit 3D
  21192. 11 11 0 0 0 0 0 0 0 0999 V2000
  21193. -0.2702 0.5052 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0
  21194. -1.2785 0.0761 -0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0
  21195. -0.9129 -0.5094 1.0223 C 0 0 0 0 0 0 0 0 0 0 0 0
  21196. 0.3682 -0.6884 1.4118 N 0 0 0 0 0 0 0 0 0 0 0 0
  21197. 1.3253 -0.2618 0.5593 C 0 0 0 0 0 0 0 0 0 0 0 0
  21198. 1.0589 0.3346 -0.6629 C 0 0 0 0 0 0 0 0 0 0 0 0
  21199. -0.5180 0.9686 -1.9865 H 0 0 0 0 0 0 0 0 0 0 0 0
  21200. -2.3238 0.1946 -0.4409 H 0 0 0 0 0 0 0 0 0 0 0 0
  21201. -1.6631 -0.8605 1.7248 H 0 0 0 0 0 0 0 0 0 0 0 0
  21202. 2.3464 -0.4171 0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0
  21203. 1.8678 0.6581 -1.3079 H 0 0 0 0 0 0 0 0 0 0 0 0
  21204. 1 2 2 0
  21205. 2 3 1 0
  21206. 3 4 2 0
  21207. 4 5 1 0
  21208. 5 6 2 0
  21209. 6 1 1 0
  21210. 1 7 1 0
  21211. 2 8 1 0
  21212. 3 9 1 0
  21213. 5 10 1 0
  21214. 6 11 1 0
  21215. M END
  21216. $$$$
  21217. RDKit 3D
  21218. 11 11 0 0 0 0 0 0 0 0999 V2000
  21219. -0.2702 0.5117 -1.0328 C 0 0 0 0 0 0 0 0 0 0 0 0
  21220. -1.2785 0.0772 -0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0
  21221. -0.9129 -0.5158 1.0191 C 0 0 0 0 0 0 0 0 0 0 0 0
  21222. 0.3682 -0.6973 1.4075 N 0 0 0 0 0 0 0 0 0 0 0 0
  21223. 1.3253 -0.2654 0.5576 C 0 0 0 0 0 0 0 0 0 0 0 0
  21224. 1.0589 0.3387 -0.6608 C 0 0 0 0 0 0 0 0 0 0 0 0
  21225. -0.5180 0.9811 -1.9804 H 0 0 0 0 0 0 0 0 0 0 0 0
  21226. -2.3238 0.1974 -0.4396 H 0 0 0 0 0 0 0 0 0 0 0 0
  21227. -1.6631 -0.8713 1.7194 H 0 0 0 0 0 0 0 0 0 0 0 0
  21228. 2.3464 -0.4227 0.8928 H 0 0 0 0 0 0 0 0 0 0 0 0
  21229. 1.8678 0.6663 -1.3038 H 0 0 0 0 0 0 0 0 0 0 0 0
  21230. 1 2 2 0
  21231. 2 3 1 0
  21232. 3 4 2 0
  21233. 4 5 1 0
  21234. 5 6 2 0
  21235. 6 1 1 0
  21236. 1 7 1 0
  21237. 2 8 1 0
  21238. 3 9 1 0
  21239. 5 10 1 0
  21240. 6 11 1 0
  21241. M END
  21242. $$$$
  21243. RDKit 3D
  21244. 11 11 0 0 0 0 0 0 0 0999 V2000
  21245. -0.2702 0.5182 -1.0296 C 0 0 0 0 0 0 0 0 0 0 0 0
  21246. -1.2785 0.0784 -0.1784 C 0 0 0 0 0 0 0 0 0 0 0 0
  21247. -0.9129 -0.5222 1.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
  21248. 0.3682 -0.7061 1.4031 N 0 0 0 0 0 0 0 0 0 0 0 0
  21249. 1.3253 -0.2688 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0
  21250. 1.0589 0.3429 -0.6586 C 0 0 0 0 0 0 0 0 0 0 0 0
  21251. -0.5180 0.9935 -1.9742 H 0 0 0 0 0 0 0 0 0 0 0 0
  21252. -2.3238 0.2001 -0.4384 H 0 0 0 0 0 0 0 0 0 0 0 0
  21253. -1.6631 -0.8821 1.7138 H 0 0 0 0 0 0 0 0 0 0 0 0
  21254. 2.3464 -0.4283 0.8901 H 0 0 0 0 0 0 0 0 0 0 0 0
  21255. 1.8678 0.6745 -1.2995 H 0 0 0 0 0 0 0 0 0 0 0 0
  21256. 1 2 2 0
  21257. 2 3 1 0
  21258. 3 4 2 0
  21259. 4 5 1 0
  21260. 5 6 2 0
  21261. 6 1 1 0
  21262. 1 7 1 0
  21263. 2 8 1 0
  21264. 3 9 1 0
  21265. 5 10 1 0
  21266. 6 11 1 0
  21267. M END
  21268. $$$$
  21269. RDKit 3D
  21270. 11 11 0 0 0 0 0 0 0 0999 V2000
  21271. -0.2702 0.5246 -1.0263 C 0 0 0 0 0 0 0 0 0 0 0 0
  21272. -1.2785 0.0795 -0.1779 C 0 0 0 0 0 0 0 0 0 0 0 0
  21273. -0.9129 -0.5285 1.0125 C 0 0 0 0 0 0 0 0 0 0 0 0
  21274. 0.3682 -0.7149 1.3986 N 0 0 0 0 0 0 0 0 0 0 0 0
  21275. 1.3253 -0.2723 0.5543 C 0 0 0 0 0 0 0 0 0 0 0 0
  21276. 1.0589 0.3470 -0.6565 C 0 0 0 0 0 0 0 0 0 0 0 0
  21277. -0.5180 1.0059 -1.9679 H 0 0 0 0 0 0 0 0 0 0 0 0
  21278. -2.3238 0.2029 -0.4371 H 0 0 0 0 0 0 0 0 0 0 0 0
  21279. -1.6631 -0.8929 1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0
  21280. 2.3464 -0.4339 0.8874 H 0 0 0 0 0 0 0 0 0 0 0 0
  21281. 1.8678 0.6827 -1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0
  21282. 1 2 2 0
  21283. 2 3 1 0
  21284. 3 4 2 0
  21285. 4 5 1 0
  21286. 5 6 2 0
  21287. 6 1 1 0
  21288. 1 7 1 0
  21289. 2 8 1 0
  21290. 3 9 1 0
  21291. 5 10 1 0
  21292. 6 11 1 0
  21293. M END
  21294. $$$$
  21295. RDKit 3D
  21296. 11 11 0 0 0 0 0 0 0 0999 V2000
  21297. -0.2702 0.5311 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  21298. -1.2785 0.0806 -0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0
  21299. -0.9129 -0.5349 1.0092 C 0 0 0 0 0 0 0 0 0 0 0 0
  21300. 0.3682 -0.7237 1.3941 N 0 0 0 0 0 0 0 0 0 0 0 0
  21301. 1.3253 -0.2758 0.5525 C 0 0 0 0 0 0 0 0 0 0 0 0
  21302. 1.0589 0.3511 -0.6543 C 0 0 0 0 0 0 0 0 0 0 0 0
  21303. -0.5180 1.0183 -1.9616 H 0 0 0 0 0 0 0 0 0 0 0 0
  21304. -2.3238 0.2056 -0.4358 H 0 0 0 0 0 0 0 0 0 0 0 0
  21305. -1.6631 -0.9036 1.7026 H 0 0 0 0 0 0 0 0 0 0 0 0
  21306. 2.3464 -0.4395 0.8846 H 0 0 0 0 0 0 0 0 0 0 0 0
  21307. 1.8678 0.6908 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0
  21308. 1 2 2 0
  21309. 2 3 1 0
  21310. 3 4 2 0
  21311. 4 5 1 0
  21312. 5 6 2 0
  21313. 6 1 1 0
  21314. 1 7 1 0
  21315. 2 8 1 0
  21316. 3 9 1 0
  21317. 5 10 1 0
  21318. 6 11 1 0
  21319. M END
  21320. $$$$
  21321. RDKit 3D
  21322. 11 11 0 0 0 0 0 0 0 0999 V2000
  21323. -0.2702 0.5375 -1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0
  21324. -1.2785 0.0817 -0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0
  21325. -0.9129 -0.5412 1.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
  21326. 0.3682 -0.7324 1.3895 N 0 0 0 0 0 0 0 0 0 0 0 0
  21327. 1.3253 -0.2793 0.5508 C 0 0 0 0 0 0 0 0 0 0 0 0
  21328. 1.0589 0.3552 -0.6521 C 0 0 0 0 0 0 0 0 0 0 0 0
  21329. -0.5180 1.0306 -1.9551 H 0 0 0 0 0 0 0 0 0 0 0 0
  21330. -2.3238 0.2084 -0.4345 H 0 0 0 0 0 0 0 0 0 0 0 0
  21331. -1.6631 -0.9143 1.6969 H 0 0 0 0 0 0 0 0 0 0 0 0
  21332. 2.3464 -0.4450 0.8819 H 0 0 0 0 0 0 0 0 0 0 0 0
  21333. 1.8678 0.6989 -1.2866 H 0 0 0 0 0 0 0 0 0 0 0 0
  21334. 1 2 2 0
  21335. 2 3 1 0
  21336. 3 4 2 0
  21337. 4 5 1 0
  21338. 5 6 2 0
  21339. 6 1 1 0
  21340. 1 7 1 0
  21341. 2 8 1 0
  21342. 3 9 1 0
  21343. 5 10 1 0
  21344. 6 11 1 0
  21345. M END
  21346. $$$$
  21347. RDKit 3D
  21348. 11 11 0 0 0 0 0 0 0 0999 V2000
  21349. -0.2702 0.5439 -1.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
  21350. -1.2785 0.0828 -0.1764 C 0 0 0 0 0 0 0 0 0 0 0 0
  21351. -0.9129 -0.5475 1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0
  21352. 0.3682 -0.7411 1.3849 N 0 0 0 0 0 0 0 0 0 0 0 0
  21353. 1.3253 -0.2827 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0
  21354. 1.0589 0.3593 -0.6498 C 0 0 0 0 0 0 0 0 0 0 0 0
  21355. -0.5180 1.0428 -1.9486 H 0 0 0 0 0 0 0 0 0 0 0 0
  21356. -2.3238 0.2111 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
  21357. -1.6631 -0.9249 1.6911 H 0 0 0 0 0 0 0 0 0 0 0 0
  21358. 2.3464 -0.4506 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  21359. 1.8678 0.7069 -1.2822 H 0 0 0 0 0 0 0 0 0 0 0 0
  21360. 1 2 2 0
  21361. 2 3 1 0
  21362. 3 4 2 0
  21363. 4 5 1 0
  21364. 5 6 2 0
  21365. 6 1 1 0
  21366. 1 7 1 0
  21367. 2 8 1 0
  21368. 3 9 1 0
  21369. 5 10 1 0
  21370. 6 11 1 0
  21371. M END
  21372. $$$$
  21373. RDKit 3D
  21374. 11 11 0 0 0 0 0 0 0 0999 V2000
  21375. -0.2702 0.5502 -1.0128 C 0 0 0 0 0 0 0 0 0 0 0 0
  21376. -1.2785 0.0839 -0.1759 C 0 0 0 0 0 0 0 0 0 0 0 0
  21377. -0.9129 -0.5538 0.9989 C 0 0 0 0 0 0 0 0 0 0 0 0
  21378. 0.3682 -0.7498 1.3802 N 0 0 0 0 0 0 0 0 0 0 0 0
  21379. 1.3253 -0.2862 0.5472 C 0 0 0 0 0 0 0 0 0 0 0 0
  21380. 1.0589 0.3634 -0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0
  21381. -0.5180 1.0551 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0
  21382. -2.3238 0.2138 -0.4319 H 0 0 0 0 0 0 0 0 0 0 0 0
  21383. -1.6631 -0.9355 1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0
  21384. 2.3464 -0.4561 0.8762 H 0 0 0 0 0 0 0 0 0 0 0 0
  21385. 1.8678 0.7150 -1.2777 H 0 0 0 0 0 0 0 0 0 0 0 0
  21386. 1 2 2 0
  21387. 2 3 1 0
  21388. 3 4 2 0
  21389. 4 5 1 0
  21390. 5 6 2 0
  21391. 6 1 1 0
  21392. 1 7 1 0
  21393. 2 8 1 0
  21394. 3 9 1 0
  21395. 5 10 1 0
  21396. 6 11 1 0
  21397. M END
  21398. $$$$
  21399. RDKit 3D
  21400. 11 11 0 0 0 0 0 0 0 0999 V2000
  21401. -0.2702 0.5566 -1.0093 C 0 0 0 0 0 0 0 0 0 0 0 0
  21402. -1.2785 0.0850 -0.1753 C 0 0 0 0 0 0 0 0 0 0 0 0
  21403. -0.9129 -0.5601 0.9954 C 0 0 0 0 0 0 0 0 0 0 0 0
  21404. 0.3682 -0.7585 1.3755 N 0 0 0 0 0 0 0 0 0 0 0 0
  21405. 1.3253 -0.2896 0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0
  21406. 1.0589 0.3675 -0.6452 C 0 0 0 0 0 0 0 0 0 0 0 0
  21407. -0.5180 1.0672 -1.9353 H 0 0 0 0 0 0 0 0 0 0 0 0
  21408. -2.3238 0.2165 -0.4305 H 0 0 0 0 0 0 0 0 0 0 0 0
  21409. -1.6631 -0.9461 1.6794 H 0 0 0 0 0 0 0 0 0 0 0 0
  21410. 2.3464 -0.4616 0.8733 H 0 0 0 0 0 0 0 0 0 0 0 0
  21411. 1.8678 0.7230 -1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0
  21412. 1 2 2 0
  21413. 2 3 1 0
  21414. 3 4 2 0
  21415. 4 5 1 0
  21416. 5 6 2 0
  21417. 6 1 1 0
  21418. 1 7 1 0
  21419. 2 8 1 0
  21420. 3 9 1 0
  21421. 5 10 1 0
  21422. 6 11 1 0
  21423. M END
  21424. $$$$
  21425. RDKit 3D
  21426. 11 11 0 0 0 0 0 0 0 0999 V2000
  21427. -0.2702 0.5629 -1.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
  21428. -1.2785 0.0861 -0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0
  21429. -0.9129 -0.5663 0.9919 C 0 0 0 0 0 0 0 0 0 0 0 0
  21430. 0.3682 -0.7671 1.3707 N 0 0 0 0 0 0 0 0 0 0 0 0
  21431. 1.3253 -0.2930 0.5436 C 0 0 0 0 0 0 0 0 0 0 0 0
  21432. 1.0589 0.3715 -0.6429 C 0 0 0 0 0 0 0 0 0 0 0 0
  21433. -0.5180 1.0794 -1.9286 H 0 0 0 0 0 0 0 0 0 0 0 0
  21434. -2.3238 0.2192 -0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0
  21435. -1.6631 -0.9566 1.6734 H 0 0 0 0 0 0 0 0 0 0 0 0
  21436. 2.3464 -0.4671 0.8704 H 0 0 0 0 0 0 0 0 0 0 0 0
  21437. 1.8678 0.7310 -1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0
  21438. 1 2 2 0
  21439. 2 3 1 0
  21440. 3 4 2 0
  21441. 4 5 1 0
  21442. 5 6 2 0
  21443. 6 1 1 0
  21444. 1 7 1 0
  21445. 2 8 1 0
  21446. 3 9 1 0
  21447. 5 10 1 0
  21448. 6 11 1 0
  21449. M END
  21450. $$$$
  21451. RDKit 3D
  21452. 11 11 0 0 0 0 0 0 0 0999 V2000
  21453. -0.2702 0.5692 -1.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
  21454. -1.2785 0.0872 -0.1742 C 0 0 0 0 0 0 0 0 0 0 0 0
  21455. -0.9129 -0.5725 0.9883 C 0 0 0 0 0 0 0 0 0 0 0 0
  21456. 0.3682 -0.7757 1.3658 N 0 0 0 0 0 0 0 0 0 0 0 0
  21457. 1.3253 -0.2964 0.5418 C 0 0 0 0 0 0 0 0 0 0 0 0
  21458. 1.0589 0.3756 -0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0
  21459. -0.5180 1.0915 -1.9218 H 0 0 0 0 0 0 0 0 0 0 0 0
  21460. -2.3238 0.2219 -0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0
  21461. -1.6631 -0.9671 1.6674 H 0 0 0 0 0 0 0 0 0 0 0 0
  21462. 2.3464 -0.4725 0.8674 H 0 0 0 0 0 0 0 0 0 0 0 0
  21463. 1.8678 0.7389 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  21464. 1 2 2 0
  21465. 2 3 1 0
  21466. 3 4 2 0
  21467. 4 5 1 0
  21468. 5 6 2 0
  21469. 6 1 1 0
  21470. 1 7 1 0
  21471. 2 8 1 0
  21472. 3 9 1 0
  21473. 5 10 1 0
  21474. 6 11 1 0
  21475. M END
  21476. $$$$
  21477. RDKit 3D
  21478. 11 11 0 0 0 0 0 0 0 0999 V2000
  21479. -0.2702 0.5755 -0.9987 C 0 0 0 0 0 0 0 0 0 0 0 0
  21480. -1.2785 0.0883 -0.1737 C 0 0 0 0 0 0 0 0 0 0 0 0
  21481. -0.9129 -0.5787 0.9847 C 0 0 0 0 0 0 0 0 0 0 0 0
  21482. 0.3682 -0.7843 1.3609 N 0 0 0 0 0 0 0 0 0 0 0 0
  21483. 1.3253 -0.2998 0.5399 C 0 0 0 0 0 0 0 0 0 0 0 0
  21484. 1.0589 0.3796 -0.6382 C 0 0 0 0 0 0 0 0 0 0 0 0
  21485. -0.5180 1.1035 -1.9149 H 0 0 0 0 0 0 0 0 0 0 0 0
  21486. -2.3238 0.2246 -0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0
  21487. -1.6631 -0.9776 1.6613 H 0 0 0 0 0 0 0 0 0 0 0 0
  21488. 2.3464 -0.4780 0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0
  21489. 1.8678 0.7469 -1.2593 H 0 0 0 0 0 0 0 0 0 0 0 0
  21490. 1 2 2 0
  21491. 2 3 1 0
  21492. 3 4 2 0
  21493. 4 5 1 0
  21494. 5 6 2 0
  21495. 6 1 1 0
  21496. 1 7 1 0
  21497. 2 8 1 0
  21498. 3 9 1 0
  21499. 5 10 1 0
  21500. 6 11 1 0
  21501. M END
  21502. $$$$
  21503. RDKit 3D
  21504. 11 11 0 0 0 0 0 0 0 0999 V2000
  21505. -0.2702 0.5818 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0
  21506. -1.2785 0.0894 -0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0
  21507. -0.9129 -0.5849 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0
  21508. 0.3682 -0.7928 1.3560 N 0 0 0 0 0 0 0 0 0 0 0 0
  21509. 1.3253 -0.3032 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0
  21510. 1.0589 0.3836 -0.6358 C 0 0 0 0 0 0 0 0 0 0 0 0
  21511. -0.5180 1.1155 -1.9079 H 0 0 0 0 0 0 0 0 0 0 0 0
  21512. -2.3238 0.2273 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0
  21513. -1.6631 -0.9880 1.6551 H 0 0 0 0 0 0 0 0 0 0 0 0
  21514. 2.3464 -0.4834 0.8614 H 0 0 0 0 0 0 0 0 0 0 0 0
  21515. 1.8678 0.7548 -1.2546 H 0 0 0 0 0 0 0 0 0 0 0 0
  21516. 1 2 2 0
  21517. 2 3 1 0
  21518. 3 4 2 0
  21519. 4 5 1 0
  21520. 5 6 2 0
  21521. 6 1 1 0
  21522. 1 7 1 0
  21523. 2 8 1 0
  21524. 3 9 1 0
  21525. 5 10 1 0
  21526. 6 11 1 0
  21527. M END
  21528. $$$$
  21529. RDKit 3D
  21530. 11 11 0 0 0 0 0 0 0 0999 V2000
  21531. -0.2702 0.5880 -0.9914 C 0 0 0 0 0 0 0 0 0 0 0 0
  21532. -1.2785 0.0905 -0.1726 C 0 0 0 0 0 0 0 0 0 0 0 0
  21533. -0.9129 -0.5911 0.9773 C 0 0 0 0 0 0 0 0 0 0 0 0
  21534. 0.3682 -0.8013 1.3510 N 0 0 0 0 0 0 0 0 0 0 0 0
  21535. 1.3253 -0.3066 0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0
  21536. 1.0589 0.3876 -0.6334 C 0 0 0 0 0 0 0 0 0 0 0 0
  21537. -0.5180 1.1275 -1.9009 H 0 0 0 0 0 0 0 0 0 0 0 0
  21538. -2.3238 0.2299 -0.4235 H 0 0 0 0 0 0 0 0 0 0 0 0
  21539. -1.6631 -0.9984 1.6488 H 0 0 0 0 0 0 0 0 0 0 0 0
  21540. 2.3464 -0.4888 0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0
  21541. 1.8678 0.7626 -1.2499 H 0 0 0 0 0 0 0 0 0 0 0 0
  21542. 1 2 2 0
  21543. 2 3 1 0
  21544. 3 4 2 0
  21545. 4 5 1 0
  21546. 5 6 2 0
  21547. 6 1 1 0
  21548. 1 7 1 0
  21549. 2 8 1 0
  21550. 3 9 1 0
  21551. 5 10 1 0
  21552. 6 11 1 0
  21553. M END
  21554. $$$$
  21555. RDKit 3D
  21556. 11 11 0 0 0 0 0 0 0 0999 V2000
  21557. -0.2702 0.5942 -0.9876 C 0 0 0 0 0 0 0 0 0 0 0 0
  21558. -1.2785 0.0916 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0
  21559. -0.9129 -0.5972 0.9736 C 0 0 0 0 0 0 0 0 0 0 0 0
  21560. 0.3682 -0.8098 1.3459 N 0 0 0 0 0 0 0 0 0 0 0 0
  21561. 1.3253 -0.3100 0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0
  21562. 1.0589 0.3915 -0.6309 C 0 0 0 0 0 0 0 0 0 0 0 0
  21563. -0.5180 1.1394 -1.8938 H 0 0 0 0 0 0 0 0 0 0 0 0
  21564. -2.3238 0.2326 -0.4221 H 0 0 0 0 0 0 0 0 0 0 0 0
  21565. -1.6631 -1.0087 1.6425 H 0 0 0 0 0 0 0 0 0 0 0 0
  21566. 2.3464 -0.4942 0.8553 H 0 0 0 0 0 0 0 0 0 0 0 0
  21567. 1.8678 0.7705 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
  21568. 1 2 2 0
  21569. 2 3 1 0
  21570. 3 4 2 0
  21571. 4 5 1 0
  21572. 5 6 2 0
  21573. 6 1 1 0
  21574. 1 7 1 0
  21575. 2 8 1 0
  21576. 3 9 1 0
  21577. 5 10 1 0
  21578. 6 11 1 0
  21579. M END
  21580. $$$$
  21581. RDKit 3D
  21582. 11 11 0 0 0 0 0 0 0 0999 V2000
  21583. -0.2702 0.6004 -0.9839 C 0 0 0 0 0 0 0 0 0 0 0 0
  21584. -1.2785 0.0927 -0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0
  21585. -0.9129 -0.6033 0.9698 C 0 0 0 0 0 0 0 0 0 0 0 0
  21586. 0.3682 -0.8182 1.3408 N 0 0 0 0 0 0 0 0 0 0 0 0
  21587. 1.3253 -0.3133 0.5322 C 0 0 0 0 0 0 0 0 0 0 0 0
  21588. 1.0589 0.3955 -0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0
  21589. -0.5180 1.1513 -1.8866 H 0 0 0 0 0 0 0 0 0 0 0 0
  21590. -2.3238 0.2352 -0.4206 H 0 0 0 0 0 0 0 0 0 0 0 0
  21591. -1.6631 -1.0190 1.6362 H 0 0 0 0 0 0 0 0 0 0 0 0
  21592. 2.3464 -0.4995 0.8522 H 0 0 0 0 0 0 0 0 0 0 0 0
  21593. 1.8678 0.7783 -1.2402 H 0 0 0 0 0 0 0 0 0 0 0 0
  21594. 1 2 2 0
  21595. 2 3 1 0
  21596. 3 4 2 0
  21597. 4 5 1 0
  21598. 5 6 2 0
  21599. 6 1 1 0
  21600. 1 7 1 0
  21601. 2 8 1 0
  21602. 3 9 1 0
  21603. 5 10 1 0
  21604. 6 11 1 0
  21605. M END
  21606. $$$$
  21607. RDKit 3D
  21608. 11 11 0 0 0 0 0 0 0 0999 V2000
  21609. -0.2702 0.6066 -0.9801 C 0 0 0 0 0 0 0 0 0 0 0 0
  21610. -1.2785 0.0937 -0.1708 C 0 0 0 0 0 0 0 0 0 0 0 0
  21611. -0.9129 -0.6094 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0
  21612. 0.3682 -0.8266 1.3356 N 0 0 0 0 0 0 0 0 0 0 0 0
  21613. 1.3253 -0.3167 0.5302 C 0 0 0 0 0 0 0 0 0 0 0 0
  21614. 1.0589 0.3994 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0
  21615. -0.5180 1.1631 -1.8793 H 0 0 0 0 0 0 0 0 0 0 0 0
  21616. -2.3238 0.2379 -0.4191 H 0 0 0 0 0 0 0 0 0 0 0 0
  21617. -1.6631 -1.0293 1.6297 H 0 0 0 0 0 0 0 0 0 0 0 0
  21618. 2.3464 -0.5049 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0
  21619. 1.8678 0.7861 -1.2353 H 0 0 0 0 0 0 0 0 0 0 0 0
  21620. 1 2 2 0
  21621. 2 3 1 0
  21622. 3 4 2 0
  21623. 4 5 1 0
  21624. 5 6 2 0
  21625. 6 1 1 0
  21626. 1 7 1 0
  21627. 2 8 1 0
  21628. 3 9 1 0
  21629. 5 10 1 0
  21630. 6 11 1 0
  21631. M END
  21632. $$$$
  21633. RDKit 3D
  21634. 11 11 0 0 0 0 0 0 0 0999 V2000
  21635. -0.2702 0.6128 -0.9763 C 0 0 0 0 0 0 0 0 0 0 0 0
  21636. -1.2785 0.0948 -0.1702 C 0 0 0 0 0 0 0 0 0 0 0 0
  21637. -0.9129 -0.6154 0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0
  21638. 0.3682 -0.8350 1.3304 N 0 0 0 0 0 0 0 0 0 0 0 0
  21639. 1.3253 -0.3200 0.5282 C 0 0 0 0 0 0 0 0 0 0 0 0
  21640. 1.0589 0.4034 -0.6234 C 0 0 0 0 0 0 0 0 0 0 0 0
  21641. -0.5180 1.1749 -1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0
  21642. -2.3238 0.2405 -0.4176 H 0 0 0 0 0 0 0 0 0 0 0 0
  21643. -1.6631 -1.0395 1.6232 H 0 0 0 0 0 0 0 0 0 0 0 0
  21644. 2.3464 -0.5102 0.8458 H 0 0 0 0 0 0 0 0 0 0 0 0
  21645. 1.8678 0.7938 -1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0
  21646. 1 2 2 0
  21647. 2 3 1 0
  21648. 3 4 2 0
  21649. 4 5 1 0
  21650. 5 6 2 0
  21651. 6 1 1 0
  21652. 1 7 1 0
  21653. 2 8 1 0
  21654. 3 9 1 0
  21655. 5 10 1 0
  21656. 6 11 1 0
  21657. M END
  21658. $$$$
  21659. RDKit 3D
  21660. 11 11 0 0 0 0 0 0 0 0999 V2000
  21661. -0.2702 0.6189 -0.9724 C 0 0 0 0 0 0 0 0 0 0 0 0
  21662. -1.2785 0.0959 -0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0
  21663. -0.9129 -0.6215 0.9583 C 0 0 0 0 0 0 0 0 0 0 0 0
  21664. 0.3682 -0.8434 1.3251 N 0 0 0 0 0 0 0 0 0 0 0 0
  21665. 1.3253 -0.3233 0.5262 C 0 0 0 0 0 0 0 0 0 0 0 0
  21666. 1.0589 0.4073 -0.6209 C 0 0 0 0 0 0 0 0 0 0 0 0
  21667. -0.5180 1.1867 -1.8645 H 0 0 0 0 0 0 0 0 0 0 0 0
  21668. -2.3238 0.2431 -0.4161 H 0 0 0 0 0 0 0 0 0 0 0 0
  21669. -1.6631 -1.0497 1.6167 H 0 0 0 0 0 0 0 0 0 0 0 0
  21670. 2.3464 -0.5155 0.8426 H 0 0 0 0 0 0 0 0 0 0 0 0
  21671. 1.8678 0.8015 -1.2253 H 0 0 0 0 0 0 0 0 0 0 0 0
  21672. 1 2 2 0
  21673. 2 3 1 0
  21674. 3 4 2 0
  21675. 4 5 1 0
  21676. 5 6 2 0
  21677. 6 1 1 0
  21678. 1 7 1 0
  21679. 2 8 1 0
  21680. 3 9 1 0
  21681. 5 10 1 0
  21682. 6 11 1 0
  21683. M END
  21684. $$$$
  21685. RDKit 3D
  21686. 11 11 0 0 0 0 0 0 0 0999 V2000
  21687. -0.2702 0.6250 -0.9685 C 0 0 0 0 0 0 0 0 0 0 0 0
  21688. -1.2785 0.0969 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0
  21689. -0.9129 -0.6275 0.9543 C 0 0 0 0 0 0 0 0 0 0 0 0
  21690. 0.3682 -0.8517 1.3198 N 0 0 0 0 0 0 0 0 0 0 0 0
  21691. 1.3253 -0.3266 0.5241 C 0 0 0 0 0 0 0 0 0 0 0 0
  21692. 1.0589 0.4112 -0.6183 C 0 0 0 0 0 0 0 0 0 0 0 0
  21693. -0.5180 1.1983 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0
  21694. -2.3238 0.2457 -0.4145 H 0 0 0 0 0 0 0 0 0 0 0 0
  21695. -1.6631 -1.0598 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0
  21696. 2.3464 -0.5208 0.8393 H 0 0 0 0 0 0 0 0 0 0 0 0
  21697. 1.8678 0.8092 -1.2202 H 0 0 0 0 0 0 0 0 0 0 0 0
  21698. 1 2 2 0
  21699. 2 3 1 0
  21700. 3 4 2 0
  21701. 4 5 1 0
  21702. 5 6 2 0
  21703. 6 1 1 0
  21704. 1 7 1 0
  21705. 2 8 1 0
  21706. 3 9 1 0
  21707. 5 10 1 0
  21708. 6 11 1 0
  21709. M END
  21710. $$$$
  21711. RDKit 3D
  21712. 11 11 0 0 0 0 0 0 0 0999 V2000
  21713. -0.2702 0.6310 -0.9646 C 0 0 0 0 0 0 0 0 0 0 0 0
  21714. -1.2785 0.0980 -0.1684 C 0 0 0 0 0 0 0 0 0 0 0 0
  21715. -0.9129 -0.6335 0.9504 C 0 0 0 0 0 0 0 0 0 0 0 0
  21716. 0.3682 -0.8599 1.3144 N 0 0 0 0 0 0 0 0 0 0 0 0
  21717. 1.3253 -0.3299 0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0
  21718. 1.0589 0.4150 -0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0
  21719. -0.5180 1.2100 -1.8495 H 0 0 0 0 0 0 0 0 0 0 0 0
  21720. -2.3238 0.2483 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  21721. -1.6631 -1.0699 1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0
  21722. 2.3464 -0.5260 0.8361 H 0 0 0 0 0 0 0 0 0 0 0 0
  21723. 1.8678 0.8169 -1.2151 H 0 0 0 0 0 0 0 0 0 0 0 0
  21724. 1 2 2 0
  21725. 2 3 1 0
  21726. 3 4 2 0
  21727. 4 5 1 0
  21728. 5 6 2 0
  21729. 6 1 1 0
  21730. 1 7 1 0
  21731. 2 8 1 0
  21732. 3 9 1 0
  21733. 5 10 1 0
  21734. 6 11 1 0
  21735. M END
  21736. $$$$
  21737. RDKit 3D
  21738. 11 11 0 0 0 0 0 0 0 0999 V2000
  21739. -0.2702 0.6371 -0.9606 C 0 0 0 0 0 0 0 0 0 0 0 0
  21740. -1.2785 0.0990 -0.1678 C 0 0 0 0 0 0 0 0 0 0 0 0
  21741. -0.9129 -0.6394 0.9464 C 0 0 0 0 0 0 0 0 0 0 0 0
  21742. 0.3682 -0.8682 1.3090 N 0 0 0 0 0 0 0 0 0 0 0 0
  21743. 1.3253 -0.3331 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0
  21744. 1.0589 0.4189 -0.6131 C 0 0 0 0 0 0 0 0 0 0 0 0
  21745. -0.5180 1.2216 -1.8418 H 0 0 0 0 0 0 0 0 0 0 0 0
  21746. -2.3238 0.2509 -0.4114 H 0 0 0 0 0 0 0 0 0 0 0 0
  21747. -1.6631 -1.0800 1.5966 H 0 0 0 0 0 0 0 0 0 0 0 0
  21748. 2.3464 -0.5313 0.8327 H 0 0 0 0 0 0 0 0 0 0 0 0
  21749. 1.8678 0.8245 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  21750. 1 2 2 0
  21751. 2 3 1 0
  21752. 3 4 2 0
  21753. 4 5 1 0
  21754. 5 6 2 0
  21755. 6 1 1 0
  21756. 1 7 1 0
  21757. 2 8 1 0
  21758. 3 9 1 0
  21759. 5 10 1 0
  21760. 6 11 1 0
  21761. M END
  21762. $$$$
  21763. RDKit 3D
  21764. 11 11 0 0 0 0 0 0 0 0999 V2000
  21765. -0.2702 0.6431 -0.9565 C 0 0 0 0 0 0 0 0 0 0 0 0
  21766. -1.2785 0.1001 -0.1672 C 0 0 0 0 0 0 0 0 0 0 0 0
  21767. -0.9129 -0.6454 0.9424 C 0 0 0 0 0 0 0 0 0 0 0 0
  21768. 0.3682 -0.8764 1.3035 N 0 0 0 0 0 0 0 0 0 0 0 0
  21769. 1.3253 -0.3364 0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0
  21770. 1.0589 0.4227 -0.6105 C 0 0 0 0 0 0 0 0 0 0 0 0
  21771. -0.5180 1.2331 -1.8341 H 0 0 0 0 0 0 0 0 0 0 0 0
  21772. -2.3238 0.2535 -0.4098 H 0 0 0 0 0 0 0 0 0 0 0 0
  21773. -1.6631 -1.0900 1.5898 H 0 0 0 0 0 0 0 0 0 0 0 0
  21774. 2.3464 -0.5365 0.8294 H 0 0 0 0 0 0 0 0 0 0 0 0
  21775. 1.8678 0.8321 -1.2048 H 0 0 0 0 0 0 0 0 0 0 0 0
  21776. 1 2 2 0
  21777. 2 3 1 0
  21778. 3 4 2 0
  21779. 4 5 1 0
  21780. 5 6 2 0
  21781. 6 1 1 0
  21782. 1 7 1 0
  21783. 2 8 1 0
  21784. 3 9 1 0
  21785. 5 10 1 0
  21786. 6 11 1 0
  21787. M END
  21788. $$$$
  21789. RDKit 3D
  21790. 11 11 0 0 0 0 0 0 0 0999 V2000
  21791. -0.2702 0.6491 -0.9525 C 0 0 0 0 0 0 0 0 0 0 0 0
  21792. -1.2785 0.1011 -0.1665 C 0 0 0 0 0 0 0 0 0 0 0 0
  21793. -0.9129 -0.6513 0.9383 C 0 0 0 0 0 0 0 0 0 0 0 0
  21794. 0.3682 -0.8846 1.2980 N 0 0 0 0 0 0 0 0 0 0 0 0
  21795. 1.3253 -0.3397 0.5158 C 0 0 0 0 0 0 0 0 0 0 0 0
  21796. 1.0589 0.4266 -0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0
  21797. -0.5180 1.2446 -1.8263 H 0 0 0 0 0 0 0 0 0 0 0 0
  21798. -2.3238 0.2561 -0.4082 H 0 0 0 0 0 0 0 0 0 0 0 0
  21799. -1.6631 -1.0999 1.5829 H 0 0 0 0 0 0 0 0 0 0 0 0
  21800. 2.3464 -0.5417 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0
  21801. 1.8678 0.8396 -1.1995 H 0 0 0 0 0 0 0 0 0 0 0 0
  21802. 1 2 2 0
  21803. 2 3 1 0
  21804. 3 4 2 0
  21805. 4 5 1 0
  21806. 5 6 2 0
  21807. 6 1 1 0
  21808. 1 7 1 0
  21809. 2 8 1 0
  21810. 3 9 1 0
  21811. 5 10 1 0
  21812. 6 11 1 0
  21813. M END
  21814. $$$$
  21815. RDKit 3D
  21816. 11 11 0 0 0 0 0 0 0 0999 V2000
  21817. -0.2702 0.6551 -0.9484 C 0 0 0 0 0 0 0 0 0 0 0 0
  21818. -1.2785 0.1022 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0
  21819. -0.9129 -0.6571 0.9342 C 0 0 0 0 0 0 0 0 0 0 0 0
  21820. 0.3682 -0.8927 1.2924 N 0 0 0 0 0 0 0 0 0 0 0 0
  21821. 1.3253 -0.3429 0.5136 C 0 0 0 0 0 0 0 0 0 0 0 0
  21822. 1.0589 0.4304 -0.6051 C 0 0 0 0 0 0 0 0 0 0 0 0
  21823. -0.5180 1.2561 -1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0
  21824. -2.3238 0.2586 -0.4066 H 0 0 0 0 0 0 0 0 0 0 0 0
  21825. -1.6631 -1.1099 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0
  21826. 2.3464 -0.5469 0.8226 H 0 0 0 0 0 0 0 0 0 0 0 0
  21827. 1.8678 0.8471 -1.1942 H 0 0 0 0 0 0 0 0 0 0 0 0
  21828. 1 2 2 0
  21829. 2 3 1 0
  21830. 3 4 2 0
  21831. 4 5 1 0
  21832. 5 6 2 0
  21833. 6 1 1 0
  21834. 1 7 1 0
  21835. 2 8 1 0
  21836. 3 9 1 0
  21837. 5 10 1 0
  21838. 6 11 1 0
  21839. M END
  21840. $$$$
  21841. RDKit 3D
  21842. 11 11 0 0 0 0 0 0 0 0999 V2000
  21843. -0.2702 0.6610 -0.9443 C 0 0 0 0 0 0 0 0 0 0 0 0
  21844. -1.2785 0.1032 -0.1653 C 0 0 0 0 0 0 0 0 0 0 0 0
  21845. -0.9129 -0.6630 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0
  21846. 0.3682 -0.9008 1.2868 N 0 0 0 0 0 0 0 0 0 0 0 0
  21847. 1.3253 -0.3461 0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0
  21848. 1.0589 0.4342 -0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0
  21849. -0.5180 1.2675 -1.8105 H 0 0 0 0 0 0 0 0 0 0 0 0
  21850. -2.3238 0.2612 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  21851. -1.6631 -1.1197 1.5689 H 0 0 0 0 0 0 0 0 0 0 0 0
  21852. 2.3464 -0.5521 0.8191 H 0 0 0 0 0 0 0 0 0 0 0 0
  21853. 1.8678 0.8546 -1.1889 H 0 0 0 0 0 0 0 0 0 0 0 0
  21854. 1 2 2 0
  21855. 2 3 1 0
  21856. 3 4 2 0
  21857. 4 5 1 0
  21858. 5 6 2 0
  21859. 6 1 1 0
  21860. 1 7 1 0
  21861. 2 8 1 0
  21862. 3 9 1 0
  21863. 5 10 1 0
  21864. 6 11 1 0
  21865. M END
  21866. $$$$
  21867. RDKit 3D
  21868. 11 11 0 0 0 0 0 0 0 0999 V2000
  21869. -0.2702 0.6670 -0.9401 C 0 0 0 0 0 0 0 0 0 0 0 0
  21870. -1.2785 0.1043 -0.1646 C 0 0 0 0 0 0 0 0 0 0 0 0
  21871. -0.9129 -0.6688 0.9258 C 0 0 0 0 0 0 0 0 0 0 0 0
  21872. 0.3682 -0.9089 1.2811 N 0 0 0 0 0 0 0 0 0 0 0 0
  21873. 1.3253 -0.3493 0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0
  21874. 1.0589 0.4379 -0.5996 C 0 0 0 0 0 0 0 0 0 0 0 0
  21875. -0.5180 1.2788 -1.8025 H 0 0 0 0 0 0 0 0 0 0 0 0
  21876. -2.3238 0.2637 -0.4033 H 0 0 0 0 0 0 0 0 0 0 0 0
  21877. -1.6631 -1.1296 1.5619 H 0 0 0 0 0 0 0 0 0 0 0 0
  21878. 2.3464 -0.5572 0.8156 H 0 0 0 0 0 0 0 0 0 0 0 0
  21879. 1.8678 0.8621 -1.1835 H 0 0 0 0 0 0 0 0 0 0 0 0
  21880. 1 2 2 0
  21881. 2 3 1 0
  21882. 3 4 2 0
  21883. 4 5 1 0
  21884. 5 6 2 0
  21885. 6 1 1 0
  21886. 1 7 1 0
  21887. 2 8 1 0
  21888. 3 9 1 0
  21889. 5 10 1 0
  21890. 6 11 1 0
  21891. M END
  21892. $$$$
  21893. RDKit 3D
  21894. 11 11 0 0 0 0 0 0 0 0999 V2000
  21895. -0.2702 0.6728 -0.9359 C 0 0 0 0 0 0 0 0 0 0 0 0
  21896. -1.2785 0.1053 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
  21897. -0.9129 -0.6746 0.9216 C 0 0 0 0 0 0 0 0 0 0 0 0
  21898. 0.3682 -0.9169 1.2753 N 0 0 0 0 0 0 0 0 0 0 0 0
  21899. 1.3253 -0.3525 0.5071 C 0 0 0 0 0 0 0 0 0 0 0 0
  21900. 1.0589 0.4417 -0.5969 C 0 0 0 0 0 0 0 0 0 0 0 0
  21901. -0.5180 1.2901 -1.7945 H 0 0 0 0 0 0 0 0 0 0 0 0
  21902. -2.3238 0.2662 -0.4017 H 0 0 0 0 0 0 0 0 0 0 0 0
  21903. -1.6631 -1.1394 1.5548 H 0 0 0 0 0 0 0 0 0 0 0 0
  21904. 2.3464 -0.5623 0.8121 H 0 0 0 0 0 0 0 0 0 0 0 0
  21905. 1.8678 0.8695 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  21906. 1 2 2 0
  21907. 2 3 1 0
  21908. 3 4 2 0
  21909. 4 5 1 0
  21910. 5 6 2 0
  21911. 6 1 1 0
  21912. 1 7 1 0
  21913. 2 8 1 0
  21914. 3 9 1 0
  21915. 5 10 1 0
  21916. 6 11 1 0
  21917. M END
  21918. $$$$
  21919. RDKit 3D
  21920. 11 11 0 0 0 0 0 0 0 0999 V2000
  21921. -0.2702 0.6787 -0.9316 C 0 0 0 0 0 0 0 0 0 0 0 0
  21922. -1.2785 0.1063 -0.1633 C 0 0 0 0 0 0 0 0 0 0 0 0
  21923. -0.9129 -0.6804 0.9174 C 0 0 0 0 0 0 0 0 0 0 0 0
  21924. 0.3682 -0.9249 1.2695 N 0 0 0 0 0 0 0 0 0 0 0 0
  21925. 1.3253 -0.3557 0.5048 C 0 0 0 0 0 0 0 0 0 0 0 0
  21926. 1.0589 0.4454 -0.5941 C 0 0 0 0 0 0 0 0 0 0 0 0
  21927. -0.5180 1.3014 -1.7863 H 0 0 0 0 0 0 0 0 0 0 0 0
  21928. -2.3238 0.2688 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0
  21929. -1.6631 -1.1491 1.5476 H 0 0 0 0 0 0 0 0 0 0 0 0
  21930. 2.3464 -0.5674 0.8086 H 0 0 0 0 0 0 0 0 0 0 0 0
  21931. 1.8678 0.8769 -1.1725 H 0 0 0 0 0 0 0 0 0 0 0 0
  21932. 1 2 2 0
  21933. 2 3 1 0
  21934. 3 4 2 0
  21935. 4 5 1 0
  21936. 5 6 2 0
  21937. 6 1 1 0
  21938. 1 7 1 0
  21939. 2 8 1 0
  21940. 3 9 1 0
  21941. 5 10 1 0
  21942. 6 11 1 0
  21943. M END
  21944. $$$$
  21945. RDKit 3D
  21946. 11 11 0 0 0 0 0 0 0 0999 V2000
  21947. -0.2702 0.6846 -0.9273 C 0 0 0 0 0 0 0 0 0 0 0 0
  21948. -1.2785 0.1074 -0.1626 C 0 0 0 0 0 0 0 0 0 0 0 0
  21949. -0.9129 -0.6862 0.9131 C 0 0 0 0 0 0 0 0 0 0 0 0
  21950. 0.3682 -0.9329 1.2637 N 0 0 0 0 0 0 0 0 0 0 0 0
  21951. 1.3253 -0.3589 0.5026 C 0 0 0 0 0 0 0 0 0 0 0 0
  21952. 1.0589 0.4492 -0.5913 C 0 0 0 0 0 0 0 0 0 0 0 0
  21953. -0.5180 1.3126 -1.7781 H 0 0 0 0 0 0 0 0 0 0 0 0
  21954. -2.3238 0.2713 -0.3983 H 0 0 0 0 0 0 0 0 0 0 0 0
  21955. -1.6631 -1.1588 1.5403 H 0 0 0 0 0 0 0 0 0 0 0 0
  21956. 2.3464 -0.5725 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0
  21957. 1.8678 0.8842 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  21958. 1 2 2 0
  21959. 2 3 1 0
  21960. 3 4 2 0
  21961. 4 5 1 0
  21962. 5 6 2 0
  21963. 6 1 1 0
  21964. 1 7 1 0
  21965. 2 8 1 0
  21966. 3 9 1 0
  21967. 5 10 1 0
  21968. 6 11 1 0
  21969. M END
  21970. $$$$
  21971. RDKit 3D
  21972. 11 11 0 0 0 0 0 0 0 0999 V2000
  21973. -0.2702 0.6904 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0
  21974. -1.2785 0.1084 -0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0
  21975. -0.9129 -0.6919 0.9087 C 0 0 0 0 0 0 0 0 0 0 0 0
  21976. 0.3682 -0.9408 1.2578 N 0 0 0 0 0 0 0 0 0 0 0 0
  21977. 1.3253 -0.3620 0.5003 C 0 0 0 0 0 0 0 0 0 0 0 0
  21978. 1.0589 0.4529 -0.5885 C 0 0 0 0 0 0 0 0 0 0 0 0
  21979. -0.5180 1.3237 -1.7698 H 0 0 0 0 0 0 0 0 0 0 0 0
  21980. -2.3238 0.2738 -0.3966 H 0 0 0 0 0 0 0 0 0 0 0 0
  21981. -1.6631 -1.1685 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0
  21982. 2.3464 -0.5775 0.8014 H 0 0 0 0 0 0 0 0 0 0 0 0
  21983. 1.8678 0.8915 -1.1614 H 0 0 0 0 0 0 0 0 0 0 0 0
  21984. 1 2 2 0
  21985. 2 3 1 0
  21986. 3 4 2 0
  21987. 4 5 1 0
  21988. 5 6 2 0
  21989. 6 1 1 0
  21990. 1 7 1 0
  21991. 2 8 1 0
  21992. 3 9 1 0
  21993. 5 10 1 0
  21994. 6 11 1 0
  21995. M END
  21996. $$$$
  21997. RDKit 3D
  21998. 11 11 0 0 0 0 0 0 0 0999 V2000
  21999. -0.2702 0.6962 -0.9187 C 0 0 0 0 0 0 0 0 0 0 0 0
  22000. -1.2785 0.1094 -0.1613 C 0 0 0 0 0 0 0 0 0 0 0 0
  22001. -0.9129 -0.6976 0.9044 C 0 0 0 0 0 0 0 0 0 0 0 0
  22002. 0.3682 -0.9487 1.2519 N 0 0 0 0 0 0 0 0 0 0 0 0
  22003. 1.3253 -0.3651 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0
  22004. 1.0589 0.4566 -0.5856 C 0 0 0 0 0 0 0 0 0 0 0 0
  22005. -0.5180 1.3348 -1.7615 H 0 0 0 0 0 0 0 0 0 0 0 0
  22006. -2.3238 0.2762 -0.3949 H 0 0 0 0 0 0 0 0 0 0 0 0
  22007. -1.6631 -1.1781 1.5256 H 0 0 0 0 0 0 0 0 0 0 0 0
  22008. 2.3464 -0.5825 0.7977 H 0 0 0 0 0 0 0 0 0 0 0 0
  22009. 1.8678 0.8988 -1.1558 H 0 0 0 0 0 0 0 0 0 0 0 0
  22010. 1 2 2 0
  22011. 2 3 1 0
  22012. 3 4 2 0
  22013. 4 5 1 0
  22014. 5 6 2 0
  22015. 6 1 1 0
  22016. 1 7 1 0
  22017. 2 8 1 0
  22018. 3 9 1 0
  22019. 5 10 1 0
  22020. 6 11 1 0
  22021. M END
  22022. $$$$
  22023. RDKit 3D
  22024. 11 11 0 0 0 0 0 0 0 0999 V2000
  22025. -0.2702 0.7019 -0.9143 C 0 0 0 0 0 0 0 0 0 0 0 0
  22026. -1.2785 0.1104 -0.1606 C 0 0 0 0 0 0 0 0 0 0 0 0
  22027. -0.9129 -0.7033 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0
  22028. 0.3682 -0.9565 1.2459 N 0 0 0 0 0 0 0 0 0 0 0 0
  22029. 1.3253 -0.3683 0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0
  22030. 1.0589 0.4602 -0.5827 C 0 0 0 0 0 0 0 0 0 0 0 0
  22031. -0.5180 1.3459 -1.7531 H 0 0 0 0 0 0 0 0 0 0 0 0
  22032. -2.3238 0.2787 -0.3931 H 0 0 0 0 0 0 0 0 0 0 0 0
  22033. -1.6631 -1.1876 1.5182 H 0 0 0 0 0 0 0 0 0 0 0 0
  22034. 2.3464 -0.5875 0.7941 H 0 0 0 0 0 0 0 0 0 0 0 0
  22035. 1.8678 0.9061 -1.1501 H 0 0 0 0 0 0 0 0 0 0 0 0
  22036. 1 2 2 0
  22037. 2 3 1 0
  22038. 3 4 2 0
  22039. 4 5 1 0
  22040. 5 6 2 0
  22041. 6 1 1 0
  22042. 1 7 1 0
  22043. 2 8 1 0
  22044. 3 9 1 0
  22045. 5 10 1 0
  22046. 6 11 1 0
  22047. M END
  22048. $$$$
  22049. RDKit 3D
  22050. 11 11 0 0 0 0 0 0 0 0999 V2000
  22051. -0.2702 0.7076 -0.9098 C 0 0 0 0 0 0 0 0 0 0 0 0
  22052. -1.2785 0.1114 -0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0
  22053. -0.9129 -0.7089 0.8955 C 0 0 0 0 0 0 0 0 0 0 0 0
  22054. 0.3682 -0.9643 1.2399 N 0 0 0 0 0 0 0 0 0 0 0 0
  22055. 1.3253 -0.3714 0.4934 C 0 0 0 0 0 0 0 0 0 0 0 0
  22056. 1.0589 0.4639 -0.5798 C 0 0 0 0 0 0 0 0 0 0 0 0
  22057. -0.5180 1.3569 -1.7446 H 0 0 0 0 0 0 0 0 0 0 0 0
  22058. -2.3238 0.2812 -0.3914 H 0 0 0 0 0 0 0 0 0 0 0 0
  22059. -1.6631 -1.1972 1.5107 H 0 0 0 0 0 0 0 0 0 0 0 0
  22060. 2.3464 -0.5925 0.7904 H 0 0 0 0 0 0 0 0 0 0 0 0
  22061. 1.8678 0.9133 -1.1444 H 0 0 0 0 0 0 0 0 0 0 0 0
  22062. 1 2 2 0
  22063. 2 3 1 0
  22064. 3 4 2 0
  22065. 4 5 1 0
  22066. 5 6 2 0
  22067. 6 1 1 0
  22068. 1 7 1 0
  22069. 2 8 1 0
  22070. 3 9 1 0
  22071. 5 10 1 0
  22072. 6 11 1 0
  22073. M END
  22074. $$$$
  22075. RDKit 3D
  22076. 11 11 0 0 0 0 0 0 0 0999 V2000
  22077. -0.2702 0.7133 -0.9054 C 0 0 0 0 0 0 0 0 0 0 0 0
  22078. -1.2785 0.1124 -0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0
  22079. -0.9129 -0.7145 0.8911 C 0 0 0 0 0 0 0 0 0 0 0 0
  22080. 0.3682 -0.9721 1.2338 N 0 0 0 0 0 0 0 0 0 0 0 0
  22081. 1.3253 -0.3745 0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0
  22082. 1.0589 0.4675 -0.5769 C 0 0 0 0 0 0 0 0 0 0 0 0
  22083. -0.5180 1.3678 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0
  22084. -2.3238 0.2836 -0.3896 H 0 0 0 0 0 0 0 0 0 0 0 0
  22085. -1.6631 -1.2066 1.5032 H 0 0 0 0 0 0 0 0 0 0 0 0
  22086. 2.3464 -0.5975 0.7866 H 0 0 0 0 0 0 0 0 0 0 0 0
  22087. 1.8678 0.9204 -1.1387 H 0 0 0 0 0 0 0 0 0 0 0 0
  22088. 1 2 2 0
  22089. 2 3 1 0
  22090. 3 4 2 0
  22091. 4 5 1 0
  22092. 5 6 2 0
  22093. 6 1 1 0
  22094. 1 7 1 0
  22095. 2 8 1 0
  22096. 3 9 1 0
  22097. 5 10 1 0
  22098. 6 11 1 0
  22099. M END
  22100. $$$$
  22101. RDKit 3D
  22102. 11 11 0 0 0 0 0 0 0 0999 V2000
  22103. -0.2702 0.7190 -0.9009 C 0 0 0 0 0 0 0 0 0 0 0 0
  22104. -1.2785 0.1134 -0.1585 C 0 0 0 0 0 0 0 0 0 0 0 0
  22105. -0.9129 -0.7201 0.8866 C 0 0 0 0 0 0 0 0 0 0 0 0
  22106. 0.3682 -0.9798 1.2277 N 0 0 0 0 0 0 0 0 0 0 0 0
  22107. 1.3253 -0.3775 0.4887 C 0 0 0 0 0 0 0 0 0 0 0 0
  22108. 1.0589 0.4711 -0.5739 C 0 0 0 0 0 0 0 0 0 0 0 0
  22109. -0.5180 1.3787 -1.7274 H 0 0 0 0 0 0 0 0 0 0 0 0
  22110. -2.3238 0.2861 -0.3878 H 0 0 0 0 0 0 0 0 0 0 0 0
  22111. -1.6631 -1.2160 1.4955 H 0 0 0 0 0 0 0 0 0 0 0 0
  22112. 2.3464 -0.6024 0.7828 H 0 0 0 0 0 0 0 0 0 0 0 0
  22113. 1.8678 0.9276 -1.1329 H 0 0 0 0 0 0 0 0 0 0 0 0
  22114. 1 2 2 0
  22115. 2 3 1 0
  22116. 3 4 2 0
  22117. 4 5 1 0
  22118. 5 6 2 0
  22119. 6 1 1 0
  22120. 1 7 1 0
  22121. 2 8 1 0
  22122. 3 9 1 0
  22123. 5 10 1 0
  22124. 6 11 1 0
  22125. M END
  22126. $$$$
  22127. RDKit 3D
  22128. 11 11 0 0 0 0 0 0 0 0999 V2000
  22129. -0.2702 0.7247 -0.8963 C 0 0 0 0 0 0 0 0 0 0 0 0
  22130. -1.2785 0.1144 -0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0
  22131. -0.9129 -0.7256 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0
  22132. 0.3682 -0.9875 1.2215 N 0 0 0 0 0 0 0 0 0 0 0 0
  22133. 1.3253 -0.3806 0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0
  22134. 1.0589 0.4747 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0
  22135. -0.5180 1.3895 -1.7187 H 0 0 0 0 0 0 0 0 0 0 0 0
  22136. -2.3238 0.2885 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  22137. -1.6631 -1.2254 1.4879 H 0 0 0 0 0 0 0 0 0 0 0 0
  22138. 2.3464 -0.6073 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0
  22139. 1.8678 0.9347 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0
  22140. 1 2 2 0
  22141. 2 3 1 0
  22142. 3 4 2 0
  22143. 4 5 1 0
  22144. 5 6 2 0
  22145. 6 1 1 0
  22146. 1 7 1 0
  22147. 2 8 1 0
  22148. 3 9 1 0
  22149. 5 10 1 0
  22150. 6 11 1 0
  22151. M END
  22152. $$$$
  22153. RDKit 3D
  22154. 11 11 0 0 0 0 0 0 0 0999 V2000
  22155. -0.2702 0.7303 -0.8918 C 0 0 0 0 0 0 0 0 0 0 0 0
  22156. -1.2785 0.1154 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0
  22157. -0.9129 -0.7312 0.8774 C 0 0 0 0 0 0 0 0 0 0 0 0
  22158. 0.3682 -0.9952 1.2152 N 0 0 0 0 0 0 0 0 0 0 0 0
  22159. 1.3253 -0.3837 0.4839 C 0 0 0 0 0 0 0 0 0 0 0 0
  22160. 1.0589 0.4783 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0
  22161. -0.5180 1.4003 -1.7099 H 0 0 0 0 0 0 0 0 0 0 0 0
  22162. -2.3238 0.2909 -0.3842 H 0 0 0 0 0 0 0 0 0 0 0 0
  22163. -1.6631 -1.2347 1.4801 H 0 0 0 0 0 0 0 0 0 0 0 0
  22164. 2.3464 -0.6122 0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0
  22165. 1.8678 0.9417 -1.1211 H 0 0 0 0 0 0 0 0 0 0 0 0
  22166. 1 2 2 0
  22167. 2 3 1 0
  22168. 3 4 2 0
  22169. 4 5 1 0
  22170. 5 6 2 0
  22171. 6 1 1 0
  22172. 1 7 1 0
  22173. 2 8 1 0
  22174. 3 9 1 0
  22175. 5 10 1 0
  22176. 6 11 1 0
  22177. M END
  22178. $$$$
  22179. RDKit 3D
  22180. 11 11 0 0 0 0 0 0 0 0999 V2000
  22181. -0.2702 0.7359 -0.8872 C 0 0 0 0 0 0 0 0 0 0 0 0
  22182. -1.2785 0.1164 -0.1563 C 0 0 0 0 0 0 0 0 0 0 0 0
  22183. -0.9129 -0.7367 0.8728 C 0 0 0 0 0 0 0 0 0 0 0 0
  22184. 0.3682 -1.0028 1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0
  22185. 1.3253 -0.3867 0.4815 C 0 0 0 0 0 0 0 0 0 0 0 0
  22186. 1.0589 0.4819 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0
  22187. -0.5180 1.4110 -1.7011 H 0 0 0 0 0 0 0 0 0 0 0 0
  22188. -2.3238 0.2933 -0.3823 H 0 0 0 0 0 0 0 0 0 0 0 0
  22189. -1.6631 -1.2440 1.4724 H 0 0 0 0 0 0 0 0 0 0 0 0
  22190. 2.3464 -0.6170 0.7713 H 0 0 0 0 0 0 0 0 0 0 0 0
  22191. 1.8678 0.9488 -1.1152 H 0 0 0 0 0 0 0 0 0 0 0 0
  22192. 1 2 2 0
  22193. 2 3 1 0
  22194. 3 4 2 0
  22195. 4 5 1 0
  22196. 5 6 2 0
  22197. 6 1 1 0
  22198. 1 7 1 0
  22199. 2 8 1 0
  22200. 3 9 1 0
  22201. 5 10 1 0
  22202. 6 11 1 0
  22203. M END
  22204. $$$$
  22205. RDKit 3D
  22206. 11 11 0 0 0 0 0 0 0 0999 V2000
  22207. -0.2702 0.7414 -0.8825 C 0 0 0 0 0 0 0 0 0 0 0 0
  22208. -1.2785 0.1173 -0.1556 C 0 0 0 0 0 0 0 0 0 0 0 0
  22209. -0.9129 -0.7421 0.8682 C 0 0 0 0 0 0 0 0 0 0 0 0
  22210. 0.3682 -1.0104 1.2026 N 0 0 0 0 0 0 0 0 0 0 0 0
  22211. 1.3253 -0.3897 0.4791 C 0 0 0 0 0 0 0 0 0 0 0 0
  22212. 1.0589 0.4854 -0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0
  22213. -0.5180 1.4216 -1.6922 H 0 0 0 0 0 0 0 0 0 0 0 0
  22214. -2.3238 0.2957 -0.3805 H 0 0 0 0 0 0 0 0 0 0 0 0
  22215. -1.6631 -1.2532 1.4645 H 0 0 0 0 0 0 0 0 0 0 0 0
  22216. 2.3464 -0.6219 0.7675 H 0 0 0 0 0 0 0 0 0 0 0 0
  22217. 1.8678 0.9558 -1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0
  22218. 1 2 2 0
  22219. 2 3 1 0
  22220. 3 4 2 0
  22221. 4 5 1 0
  22222. 5 6 2 0
  22223. 6 1 1 0
  22224. 1 7 1 0
  22225. 2 8 1 0
  22226. 3 9 1 0
  22227. 5 10 1 0
  22228. 6 11 1 0
  22229. M END
  22230. $$$$
  22231. RDKit 3D
  22232. 11 11 0 0 0 0 0 0 0 0999 V2000
  22233. -0.2702 0.7470 -0.8779 C 0 0 0 0 0 0 0 0 0 0 0 0
  22234. -1.2785 0.1183 -0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0
  22235. -0.9129 -0.7476 0.8635 C 0 0 0 0 0 0 0 0 0 0 0 0
  22236. 0.3682 -1.0179 1.1963 N 0 0 0 0 0 0 0 0 0 0 0 0
  22237. 1.3253 -0.3927 0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0
  22238. 1.0589 0.4889 -0.5589 C 0 0 0 0 0 0 0 0 0 0 0 0
  22239. -0.5180 1.4322 -1.6832 H 0 0 0 0 0 0 0 0 0 0 0 0
  22240. -2.3238 0.2981 -0.3786 H 0 0 0 0 0 0 0 0 0 0 0 0
  22241. -1.6631 -1.2624 1.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
  22242. 2.3464 -0.6267 0.7635 H 0 0 0 0 0 0 0 0 0 0 0 0
  22243. 1.8678 0.9627 -1.1032 H 0 0 0 0 0 0 0 0 0 0 0 0
  22244. 1 2 2 0
  22245. 2 3 1 0
  22246. 3 4 2 0
  22247. 4 5 1 0
  22248. 5 6 2 0
  22249. 6 1 1 0
  22250. 1 7 1 0
  22251. 2 8 1 0
  22252. 3 9 1 0
  22253. 5 10 1 0
  22254. 6 11 1 0
  22255. M END
  22256. $$$$
  22257. RDKit 3D
  22258. 11 11 0 0 0 0 0 0 0 0999 V2000
  22259. -0.2702 0.7525 -0.8731 C 0 0 0 0 0 0 0 0 0 0 0 0
  22260. -1.2785 0.1193 -0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0
  22261. -0.9129 -0.7530 0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0
  22262. 0.3682 -1.0254 1.1899 N 0 0 0 0 0 0 0 0 0 0 0 0
  22263. 1.3253 -0.3957 0.4741 C 0 0 0 0 0 0 0 0 0 0 0 0
  22264. 1.0589 0.4924 -0.5558 C 0 0 0 0 0 0 0 0 0 0 0 0
  22265. -0.5180 1.4428 -1.6742 H 0 0 0 0 0 0 0 0 0 0 0 0
  22266. -2.3238 0.3005 -0.3767 H 0 0 0 0 0 0 0 0 0 0 0 0
  22267. -1.6631 -1.2715 1.4486 H 0 0 0 0 0 0 0 0 0 0 0 0
  22268. 2.3464 -0.6315 0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0
  22269. 1.8678 0.9696 -1.0971 H 0 0 0 0 0 0 0 0 0 0 0 0
  22270. 1 2 2 0
  22271. 2 3 1 0
  22272. 3 4 2 0
  22273. 4 5 1 0
  22274. 5 6 2 0
  22275. 6 1 1 0
  22276. 1 7 1 0
  22277. 2 8 1 0
  22278. 3 9 1 0
  22279. 5 10 1 0
  22280. 6 11 1 0
  22281. M END
  22282. $$$$
  22283. RDKit 3D
  22284. 11 11 0 0 0 0 0 0 0 0999 V2000
  22285. -0.2702 0.7579 -0.8684 C 0 0 0 0 0 0 0 0 0 0 0 0
  22286. -1.2785 0.1203 -0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0
  22287. -0.9129 -0.7584 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0
  22288. 0.3682 -1.0329 1.1834 N 0 0 0 0 0 0 0 0 0 0 0 0
  22289. 1.3253 -0.3987 0.4716 C 0 0 0 0 0 0 0 0 0 0 0 0
  22290. 1.0589 0.4959 -0.5527 C 0 0 0 0 0 0 0 0 0 0 0 0
  22291. -0.5180 1.4533 -1.6651 H 0 0 0 0 0 0 0 0 0 0 0 0
  22292. -2.3238 0.3029 -0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0
  22293. -1.6631 -1.2806 1.4406 H 0 0 0 0 0 0 0 0 0 0 0 0
  22294. 2.3464 -0.6362 0.7556 H 0 0 0 0 0 0 0 0 0 0 0 0
  22295. 1.8678 0.9765 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0
  22296. 1 2 2 0
  22297. 2 3 1 0
  22298. 3 4 2 0
  22299. 4 5 1 0
  22300. 5 6 2 0
  22301. 6 1 1 0
  22302. 1 7 1 0
  22303. 2 8 1 0
  22304. 3 9 1 0
  22305. 5 10 1 0
  22306. 6 11 1 0
  22307. M END
  22308. $$$$
  22309. RDKit 3D
  22310. 11 11 0 0 0 0 0 0 0 0999 V2000
  22311. -0.2702 0.7634 -0.8636 C 0 0 0 0 0 0 0 0 0 0 0 0
  22312. -1.2785 0.1212 -0.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
  22313. -0.9129 -0.7637 0.8493 C 0 0 0 0 0 0 0 0 0 0 0 0
  22314. 0.3682 -1.0403 1.1769 N 0 0 0 0 0 0 0 0 0 0 0 0
  22315. 1.3253 -0.4016 0.4691 C 0 0 0 0 0 0 0 0 0 0 0 0
  22316. 1.0589 0.4994 -0.5495 C 0 0 0 0 0 0 0 0 0 0 0 0
  22317. -0.5180 1.4637 -1.6559 H 0 0 0 0 0 0 0 0 0 0 0 0
  22318. -2.3238 0.3052 -0.3729 H 0 0 0 0 0 0 0 0 0 0 0 0
  22319. -1.6631 -1.2896 1.4326 H 0 0 0 0 0 0 0 0 0 0 0 0
  22320. 2.3464 -0.6410 0.7516 H 0 0 0 0 0 0 0 0 0 0 0 0
  22321. 1.8678 0.9833 -1.0848 H 0 0 0 0 0 0 0 0 0 0 0 0
  22322. 1 2 2 0
  22323. 2 3 1 0
  22324. 3 4 2 0
  22325. 4 5 1 0
  22326. 5 6 2 0
  22327. 6 1 1 0
  22328. 1 7 1 0
  22329. 2 8 1 0
  22330. 3 9 1 0
  22331. 5 10 1 0
  22332. 6 11 1 0
  22333. M END
  22334. $$$$
  22335. RDKit 3D
  22336. 11 11 0 0 0 0 0 0 0 0999 V2000
  22337. -0.2702 0.7688 -0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0
  22338. -1.2785 0.1222 -0.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
  22339. -0.9129 -0.7690 0.8444 C 0 0 0 0 0 0 0 0 0 0 0 0
  22340. 0.3682 -1.0476 1.1703 N 0 0 0 0 0 0 0 0 0 0 0 0
  22341. 1.3253 -0.4046 0.4666 C 0 0 0 0 0 0 0 0 0 0 0 0
  22342. 1.0589 0.5028 -0.5464 C 0 0 0 0 0 0 0 0 0 0 0 0
  22343. -0.5180 1.4741 -1.6467 H 0 0 0 0 0 0 0 0 0 0 0 0
  22344. -2.3238 0.3075 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  22345. -1.6631 -1.2986 1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0
  22346. 2.3464 -0.6457 0.7475 H 0 0 0 0 0 0 0 0 0 0 0 0
  22347. 1.8678 0.9901 -1.0786 H 0 0 0 0 0 0 0 0 0 0 0 0
  22348. 1 2 2 0
  22349. 2 3 1 0
  22350. 3 4 2 0
  22351. 4 5 1 0
  22352. 5 6 2 0
  22353. 6 1 1 0
  22354. 1 7 1 0
  22355. 2 8 1 0
  22356. 3 9 1 0
  22357. 5 10 1 0
  22358. 6 11 1 0
  22359. M END
  22360. $$$$
  22361. RDKit 3D
  22362. 11 11 0 0 0 0 0 0 0 0999 V2000
  22363. -0.2702 0.7742 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0
  22364. -1.2785 0.1231 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  22365. -0.9129 -0.7743 0.8396 C 0 0 0 0 0 0 0 0 0 0 0 0
  22366. 0.3682 -1.0550 1.1637 N 0 0 0 0 0 0 0 0 0 0 0 0
  22367. 1.3253 -0.4075 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0
  22368. 1.0589 0.5062 -0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0
  22369. -0.5180 1.4844 -1.6374 H 0 0 0 0 0 0 0 0 0 0 0 0
  22370. -2.3238 0.3099 -0.3691 H 0 0 0 0 0 0 0 0 0 0 0 0
  22371. -1.6631 -1.3075 1.4162 H 0 0 0 0 0 0 0 0 0 0 0 0
  22372. 2.3464 -0.6504 0.7435 H 0 0 0 0 0 0 0 0 0 0 0 0
  22373. 1.8678 0.9969 -1.0724 H 0 0 0 0 0 0 0 0 0 0 0 0
  22374. 1 2 2 0
  22375. 2 3 1 0
  22376. 3 4 2 0
  22377. 4 5 1 0
  22378. 5 6 2 0
  22379. 6 1 1 0
  22380. 1 7 1 0
  22381. 2 8 1 0
  22382. 3 9 1 0
  22383. 5 10 1 0
  22384. 6 11 1 0
  22385. M END
  22386. $$$$
  22387. RDKit 3D
  22388. 11 11 0 0 0 0 0 0 0 0999 V2000
  22389. -0.2702 0.7795 -0.8491 C 0 0 0 0 0 0 0 0 0 0 0 0
  22390. -1.2785 0.1241 -0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0
  22391. -0.9129 -0.7796 0.8347 C 0 0 0 0 0 0 0 0 0 0 0 0
  22392. 0.3682 -1.0623 1.1571 N 0 0 0 0 0 0 0 0 0 0 0 0
  22393. 1.3253 -0.4104 0.4615 C 0 0 0 0 0 0 0 0 0 0 0 0
  22394. 1.0589 0.5096 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0
  22395. -0.5180 1.4947 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0
  22396. -2.3238 0.3122 -0.3671 H 0 0 0 0 0 0 0 0 0 0 0 0
  22397. -1.6631 -1.3164 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0
  22398. 2.3464 -0.6550 0.7394 H 0 0 0 0 0 0 0 0 0 0 0 0
  22399. 1.8678 1.0036 -1.0661 H 0 0 0 0 0 0 0 0 0 0 0 0
  22400. 1 2 2 0
  22401. 2 3 1 0
  22402. 3 4 2 0
  22403. 4 5 1 0
  22404. 5 6 2 0
  22405. 6 1 1 0
  22406. 1 7 1 0
  22407. 2 8 1 0
  22408. 3 9 1 0
  22409. 5 10 1 0
  22410. 6 11 1 0
  22411. M END
  22412. $$$$
  22413. RDKit 3D
  22414. 11 11 0 0 0 0 0 0 0 0999 V2000
  22415. -0.2702 0.7848 -0.8442 C 0 0 0 0 0 0 0 0 0 0 0 0
  22416. -1.2785 0.1250 -0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0
  22417. -0.9129 -0.7848 0.8298 C 0 0 0 0 0 0 0 0 0 0 0 0
  22418. 0.3682 -1.0695 1.1504 N 0 0 0 0 0 0 0 0 0 0 0 0
  22419. 1.3253 -0.4133 0.4589 C 0 0 0 0 0 0 0 0 0 0 0 0
  22420. 1.0589 0.5130 -0.5368 C 0 0 0 0 0 0 0 0 0 0 0 0
  22421. -0.5180 1.5049 -1.6186 H 0 0 0 0 0 0 0 0 0 0 0 0
  22422. -2.3238 0.3145 -0.3651 H 0 0 0 0 0 0 0 0 0 0 0 0
  22423. -1.6631 -1.3252 1.3997 H 0 0 0 0 0 0 0 0 0 0 0 0
  22424. 2.3464 -0.6597 0.7352 H 0 0 0 0 0 0 0 0 0 0 0 0
  22425. 1.8678 1.0103 -1.0598 H 0 0 0 0 0 0 0 0 0 0 0 0
  22426. 1 2 2 0
  22427. 2 3 1 0
  22428. 3 4 2 0
  22429. 4 5 1 0
  22430. 5 6 2 0
  22431. 6 1 1 0
  22432. 1 7 1 0
  22433. 2 8 1 0
  22434. 3 9 1 0
  22435. 5 10 1 0
  22436. 6 11 1 0
  22437. M END
  22438. $$$$
  22439. RDKit 3D
  22440. 11 11 0 0 0 0 0 0 0 0999 V2000
  22441. -0.2702 0.7901 -0.8392 C 0 0 0 0 0 0 0 0 0 0 0 0
  22442. -1.2785 0.1260 -0.1487 C 0 0 0 0 0 0 0 0 0 0 0 0
  22443. -0.9129 -0.7900 0.8248 C 0 0 0 0 0 0 0 0 0 0 0 0
  22444. 0.3682 -1.0767 1.1436 N 0 0 0 0 0 0 0 0 0 0 0 0
  22445. 1.3253 -0.4162 0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0
  22446. 1.0589 0.5164 -0.5336 C 0 0 0 0 0 0 0 0 0 0 0 0
  22447. -0.5180 1.5150 -1.6091 H 0 0 0 0 0 0 0 0 0 0 0 0
  22448. -2.3238 0.3168 -0.3632 H 0 0 0 0 0 0 0 0 0 0 0 0
  22449. -1.6631 -1.3340 1.3913 H 0 0 0 0 0 0 0 0 0 0 0 0
  22450. 2.3464 -0.6643 0.7311 H 0 0 0 0 0 0 0 0 0 0 0 0
  22451. 1.8678 1.0169 -1.0534 H 0 0 0 0 0 0 0 0 0 0 0 0
  22452. 1 2 2 0
  22453. 2 3 1 0
  22454. 3 4 2 0
  22455. 4 5 1 0
  22456. 5 6 2 0
  22457. 6 1 1 0
  22458. 1 7 1 0
  22459. 2 8 1 0
  22460. 3 9 1 0
  22461. 5 10 1 0
  22462. 6 11 1 0
  22463. M END
  22464. $$$$
  22465. RDKit 3D
  22466. 11 11 0 0 0 0 0 0 0 0999 V2000
  22467. -0.2702 0.7954 -0.8342 C 0 0 0 0 0 0 0 0 0 0 0 0
  22468. -1.2785 0.1269 -0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0
  22469. -0.9129 -0.7952 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0
  22470. 0.3682 -1.0839 1.1368 N 0 0 0 0 0 0 0 0 0 0 0 0
  22471. 1.3253 -0.4190 0.4537 C 0 0 0 0 0 0 0 0 0 0 0 0
  22472. 1.0589 0.5197 -0.5303 C 0 0 0 0 0 0 0 0 0 0 0 0
  22473. -0.5180 1.5251 -1.5996 H 0 0 0 0 0 0 0 0 0 0 0 0
  22474. -2.3238 0.3190 -0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0
  22475. -1.6631 -1.3427 1.3829 H 0 0 0 0 0 0 0 0 0 0 0 0
  22476. 2.3464 -0.6688 0.7269 H 0 0 0 0 0 0 0 0 0 0 0 0
  22477. 1.8678 1.0235 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0
  22478. 1 2 2 0
  22479. 2 3 1 0
  22480. 3 4 2 0
  22481. 4 5 1 0
  22482. 5 6 2 0
  22483. 6 1 1 0
  22484. 1 7 1 0
  22485. 2 8 1 0
  22486. 3 9 1 0
  22487. 5 10 1 0
  22488. 6 11 1 0
  22489. M END
  22490. $$$$
  22491. RDKit 3D
  22492. 11 11 0 0 0 0 0 0 0 0999 V2000
  22493. -0.2702 0.8006 -0.8292 C 0 0 0 0 0 0 0 0 0 0 0 0
  22494. -1.2785 0.1278 -0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0
  22495. -0.9129 -0.8003 0.8149 C 0 0 0 0 0 0 0 0 0 0 0 0
  22496. 0.3682 -1.0910 1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0
  22497. 1.3253 -0.4219 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0
  22498. 1.0589 0.5231 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0
  22499. -0.5180 1.5351 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0
  22500. -2.3238 0.3213 -0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0
  22501. -1.6631 -1.3514 1.3745 H 0 0 0 0 0 0 0 0 0 0 0 0
  22502. 2.3464 -0.6734 0.7227 H 0 0 0 0 0 0 0 0 0 0 0 0
  22503. 1.8678 1.0301 -1.0405 H 0 0 0 0 0 0 0 0 0 0 0 0
  22504. 1 2 2 0
  22505. 2 3 1 0
  22506. 3 4 2 0
  22507. 4 5 1 0
  22508. 5 6 2 0
  22509. 6 1 1 0
  22510. 1 7 1 0
  22511. 2 8 1 0
  22512. 3 9 1 0
  22513. 5 10 1 0
  22514. 6 11 1 0
  22515. M END
  22516. $$$$
  22517. RDKit 3D
  22518. 11 11 0 0 0 0 0 0 0 0999 V2000
  22519. -0.2702 0.8058 -0.8242 C 0 0 0 0 0 0 0 0 0 0 0 0
  22520. -1.2785 0.1287 -0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0
  22521. -0.9129 -0.8054 0.8098 C 0 0 0 0 0 0 0 0 0 0 0 0
  22522. 0.3682 -1.0981 1.1231 N 0 0 0 0 0 0 0 0 0 0 0 0
  22523. 1.3253 -0.4247 0.4484 C 0 0 0 0 0 0 0 0 0 0 0 0
  22524. 1.0589 0.5264 -0.5238 C 0 0 0 0 0 0 0 0 0 0 0 0
  22525. -0.5180 1.5451 -1.5803 H 0 0 0 0 0 0 0 0 0 0 0 0
  22526. -2.3238 0.3236 -0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0
  22527. -1.6631 -1.3600 1.3659 H 0 0 0 0 0 0 0 0 0 0 0 0
  22528. 2.3464 -0.6779 0.7184 H 0 0 0 0 0 0 0 0 0 0 0 0
  22529. 1.8678 1.0366 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0
  22530. 1 2 2 0
  22531. 2 3 1 0
  22532. 3 4 2 0
  22533. 4 5 1 0
  22534. 5 6 2 0
  22535. 6 1 1 0
  22536. 1 7 1 0
  22537. 2 8 1 0
  22538. 3 9 1 0
  22539. 5 10 1 0
  22540. 6 11 1 0
  22541. M END
  22542. $$$$
  22543. RDKit 3D
  22544. 11 11 0 0 0 0 0 0 0 0999 V2000
  22545. -0.2702 0.8110 -0.8191 C 0 0 0 0 0 0 0 0 0 0 0 0
  22546. -1.2785 0.1297 -0.1455 C 0 0 0 0 0 0 0 0 0 0 0 0
  22547. -0.9129 -0.8105 0.8047 C 0 0 0 0 0 0 0 0 0 0 0 0
  22548. 0.3682 -1.1051 1.1162 N 0 0 0 0 0 0 0 0 0 0 0 0
  22549. 1.3253 -0.4275 0.4457 C 0 0 0 0 0 0 0 0 0 0 0 0
  22550. 1.0589 0.5296 -0.5204 C 0 0 0 0 0 0 0 0 0 0 0 0
  22551. -0.5180 1.5550 -1.5706 H 0 0 0 0 0 0 0 0 0 0 0 0
  22552. -2.3238 0.3258 -0.3551 H 0 0 0 0 0 0 0 0 0 0 0 0
  22553. -1.6631 -1.3686 1.3574 H 0 0 0 0 0 0 0 0 0 0 0 0
  22554. 2.3464 -0.6824 0.7142 H 0 0 0 0 0 0 0 0 0 0 0 0
  22555. 1.8678 1.0431 -1.0275 H 0 0 0 0 0 0 0 0 0 0 0 0
  22556. 1 2 2 0
  22557. 2 3 1 0
  22558. 3 4 2 0
  22559. 4 5 1 0
  22560. 5 6 2 0
  22561. 6 1 1 0
  22562. 1 7 1 0
  22563. 2 8 1 0
  22564. 3 9 1 0
  22565. 5 10 1 0
  22566. 6 11 1 0
  22567. M END
  22568. $$$$
  22569. RDKit 3D
  22570. 11 11 0 0 0 0 0 0 0 0999 V2000
  22571. -0.2702 0.8161 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0
  22572. -1.2785 0.1306 -0.1446 C 0 0 0 0 0 0 0 0 0 0 0 0
  22573. -0.9129 -0.8155 0.7996 C 0 0 0 0 0 0 0 0 0 0 0 0
  22574. 0.3682 -1.1121 1.1092 N 0 0 0 0 0 0 0 0 0 0 0 0
  22575. 1.3253 -0.4303 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0
  22576. 1.0589 0.5329 -0.5171 C 0 0 0 0 0 0 0 0 0 0 0 0
  22577. -0.5180 1.5648 -1.5608 H 0 0 0 0 0 0 0 0 0 0 0 0
  22578. -2.3238 0.3280 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0
  22579. -1.6631 -1.3771 1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0
  22580. 2.3464 -0.6869 0.7099 H 0 0 0 0 0 0 0 0 0 0 0 0
  22581. 1.8678 1.0495 -1.0209 H 0 0 0 0 0 0 0 0 0 0 0 0
  22582. 1 2 2 0
  22583. 2 3 1 0
  22584. 3 4 2 0
  22585. 4 5 1 0
  22586. 5 6 2 0
  22587. 6 1 1 0
  22588. 1 7 1 0
  22589. 2 8 1 0
  22590. 3 9 1 0
  22591. 5 10 1 0
  22592. 6 11 1 0
  22593. M END
  22594. $$$$
  22595. RDKit 3D
  22596. 11 11 0 0 0 0 0 0 0 0999 V2000
  22597. -0.2702 0.8212 -0.8088 C 0 0 0 0 0 0 0 0 0 0 0 0
  22598. -1.2785 0.1315 -0.1438 C 0 0 0 0 0 0 0 0 0 0 0 0
  22599. -0.9129 -0.8206 0.7945 C 0 0 0 0 0 0 0 0 0 0 0 0
  22600. 0.3682 -1.1191 1.1022 N 0 0 0 0 0 0 0 0 0 0 0 0
  22601. 1.3253 -0.4331 0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0
  22602. 1.0589 0.5361 -0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0
  22603. -0.5180 1.5746 -1.5509 H 0 0 0 0 0 0 0 0 0 0 0 0
  22604. -2.3238 0.3302 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0
  22605. -1.6631 -1.3855 1.3401 H 0 0 0 0 0 0 0 0 0 0 0 0
  22606. 2.3464 -0.6913 0.7055 H 0 0 0 0 0 0 0 0 0 0 0 0
  22607. 1.8678 1.0559 -1.0143 H 0 0 0 0 0 0 0 0 0 0 0 0
  22608. 1 2 2 0
  22609. 2 3 1 0
  22610. 3 4 2 0
  22611. 4 5 1 0
  22612. 5 6 2 0
  22613. 6 1 1 0
  22614. 1 7 1 0
  22615. 2 8 1 0
  22616. 3 9 1 0
  22617. 5 10 1 0
  22618. 6 11 1 0
  22619. M END
  22620. $$$$
  22621. RDKit 3D
  22622. 11 11 0 0 0 0 0 0 0 0999 V2000
  22623. -0.2702 0.8263 -0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0
  22624. -1.2785 0.1324 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0
  22625. -0.9129 -0.8255 0.7893 C 0 0 0 0 0 0 0 0 0 0 0 0
  22626. 0.3682 -1.1260 1.0952 N 0 0 0 0 0 0 0 0 0 0 0 0
  22627. 1.3253 -0.4358 0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0
  22628. 1.0589 0.5394 -0.5104 C 0 0 0 0 0 0 0 0 0 0 0 0
  22629. -0.5180 1.5843 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0
  22630. -2.3238 0.3324 -0.3489 H 0 0 0 0 0 0 0 0 0 0 0 0
  22631. -1.6631 -1.3939 1.3313 H 0 0 0 0 0 0 0 0 0 0 0 0
  22632. 2.3464 -0.6958 0.7012 H 0 0 0 0 0 0 0 0 0 0 0 0
  22633. 1.8678 1.0623 -1.0077 H 0 0 0 0 0 0 0 0 0 0 0 0
  22634. 1 2 2 0
  22635. 2 3 1 0
  22636. 3 4 2 0
  22637. 4 5 1 0
  22638. 5 6 2 0
  22639. 6 1 1 0
  22640. 1 7 1 0
  22641. 2 8 1 0
  22642. 3 9 1 0
  22643. 5 10 1 0
  22644. 6 11 1 0
  22645. M END
  22646. $$$$
  22647. RDKit 3D
  22648. 11 11 0 0 0 0 0 0 0 0999 V2000
  22649. -0.2702 0.8313 -0.7985 C 0 0 0 0 0 0 0 0 0 0 0 0
  22650. -1.2785 0.1333 -0.1422 C 0 0 0 0 0 0 0 0 0 0 0 0
  22651. -0.9129 -0.8305 0.7841 C 0 0 0 0 0 0 0 0 0 0 0 0
  22652. 0.3682 -1.1328 1.0881 N 0 0 0 0 0 0 0 0 0 0 0 0
  22653. 1.3253 -0.4386 0.4348 C 0 0 0 0 0 0 0 0 0 0 0 0
  22654. 1.0589 0.5425 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0
  22655. -0.5180 1.5939 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0
  22656. -2.3238 0.3346 -0.3468 H 0 0 0 0 0 0 0 0 0 0 0 0
  22657. -1.6631 -1.4022 1.3226 H 0 0 0 0 0 0 0 0 0 0 0 0
  22658. 2.3464 -0.7002 0.6968 H 0 0 0 0 0 0 0 0 0 0 0 0
  22659. 1.8678 1.0686 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  22660. 1 2 2 0
  22661. 2 3 1 0
  22662. 3 4 2 0
  22663. 4 5 1 0
  22664. 5 6 2 0
  22665. 6 1 1 0
  22666. 1 7 1 0
  22667. 2 8 1 0
  22668. 3 9 1 0
  22669. 5 10 1 0
  22670. 6 11 1 0
  22671. M END
  22672. $$$$
  22673. RDKit 3D
  22674. 11 11 0 0 0 0 0 0 0 0999 V2000
  22675. -0.2702 0.8363 -0.7932 C 0 0 0 0 0 0 0 0 0 0 0 0
  22676. -1.2785 0.1342 -0.1413 C 0 0 0 0 0 0 0 0 0 0 0 0
  22677. -0.9129 -0.8354 0.7789 C 0 0 0 0 0 0 0 0 0 0 0 0
  22678. 0.3682 -1.1396 1.0809 N 0 0 0 0 0 0 0 0 0 0 0 0
  22679. 1.3253 -0.4413 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0
  22680. 1.0589 0.5457 -0.5035 C 0 0 0 0 0 0 0 0 0 0 0 0
  22681. -0.5180 1.6035 -1.5209 H 0 0 0 0 0 0 0 0 0 0 0 0
  22682. -2.3238 0.3368 -0.3447 H 0 0 0 0 0 0 0 0 0 0 0 0
  22683. -1.6631 -1.4105 1.3137 H 0 0 0 0 0 0 0 0 0 0 0 0
  22684. 2.3464 -0.7045 0.6924 H 0 0 0 0 0 0 0 0 0 0 0 0
  22685. 1.8678 1.0748 -0.9942 H 0 0 0 0 0 0 0 0 0 0 0 0
  22686. 1 2 2 0
  22687. 2 3 1 0
  22688. 3 4 2 0
  22689. 4 5 1 0
  22690. 5 6 2 0
  22691. 6 1 1 0
  22692. 1 7 1 0
  22693. 2 8 1 0
  22694. 3 9 1 0
  22695. 5 10 1 0
  22696. 6 11 1 0
  22697. M END
  22698. $$$$
  22699. RDKit 3D
  22700. 11 11 0 0 0 0 0 0 0 0999 V2000
  22701. -0.2702 0.8413 -0.7879 C 0 0 0 0 0 0 0 0 0 0 0 0
  22702. -1.2785 0.1350 -0.1405 C 0 0 0 0 0 0 0 0 0 0 0 0
  22703. -0.9129 -0.8403 0.7736 C 0 0 0 0 0 0 0 0 0 0 0 0
  22704. 0.3682 -1.1464 1.0738 N 0 0 0 0 0 0 0 0 0 0 0 0
  22705. 1.3253 -0.4440 0.4292 C 0 0 0 0 0 0 0 0 0 0 0 0
  22706. 1.0589 0.5489 -0.5001 C 0 0 0 0 0 0 0 0 0 0 0 0
  22707. -0.5180 1.6131 -1.5108 H 0 0 0 0 0 0 0 0 0 0 0 0
  22708. -2.3238 0.3389 -0.3426 H 0 0 0 0 0 0 0 0 0 0 0 0
  22709. -1.6631 -1.4187 1.3048 H 0 0 0 0 0 0 0 0 0 0 0 0
  22710. 2.3464 -0.7089 0.6879 H 0 0 0 0 0 0 0 0 0 0 0 0
  22711. 1.8678 1.0811 -0.9875 H 0 0 0 0 0 0 0 0 0 0 0 0
  22712. 1 2 2 0
  22713. 2 3 1 0
  22714. 3 4 2 0
  22715. 4 5 1 0
  22716. 5 6 2 0
  22717. 6 1 1 0
  22718. 1 7 1 0
  22719. 2 8 1 0
  22720. 3 9 1 0
  22721. 5 10 1 0
  22722. 6 11 1 0
  22723. M END
  22724. $$$$
  22725. RDKit 3D
  22726. 11 11 0 0 0 0 0 0 0 0999 V2000
  22727. -0.2702 0.8462 -0.7826 C 0 0 0 0 0 0 0 0 0 0 0 0
  22728. -1.2785 0.1359 -0.1396 C 0 0 0 0 0 0 0 0 0 0 0 0
  22729. -0.9129 -0.8451 0.7683 C 0 0 0 0 0 0 0 0 0 0 0 0
  22730. 0.3682 -1.1531 1.0665 N 0 0 0 0 0 0 0 0 0 0 0 0
  22731. 1.3253 -0.4467 0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0
  22732. 1.0589 0.5520 -0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0
  22733. -0.5180 1.6225 -1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0
  22734. -2.3238 0.3411 -0.3404 H 0 0 0 0 0 0 0 0 0 0 0 0
  22735. -1.6631 -1.4269 1.2959 H 0 0 0 0 0 0 0 0 0 0 0 0
  22736. 2.3464 -0.7132 0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0
  22737. 1.8678 1.0872 -0.9807 H 0 0 0 0 0 0 0 0 0 0 0 0
  22738. 1 2 2 0
  22739. 2 3 1 0
  22740. 3 4 2 0
  22741. 4 5 1 0
  22742. 5 6 2 0
  22743. 6 1 1 0
  22744. 1 7 1 0
  22745. 2 8 1 0
  22746. 3 9 1 0
  22747. 5 10 1 0
  22748. 6 11 1 0
  22749. M END
  22750. $$$$
  22751. RDKit 3D
  22752. 11 11 0 0 0 0 0 0 0 0999 V2000
  22753. -0.2702 0.8511 -0.7773 C 0 0 0 0 0 0 0 0 0 0 0 0
  22754. -1.2785 0.1368 -0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0
  22755. -0.9129 -0.8499 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0
  22756. 0.3682 -1.1598 1.0593 N 0 0 0 0 0 0 0 0 0 0 0 0
  22757. 1.3253 -0.4493 0.4236 C 0 0 0 0 0 0 0 0 0 0 0 0
  22758. 1.0589 0.5551 -0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0
  22759. -0.5180 1.6319 -1.4904 H 0 0 0 0 0 0 0 0 0 0 0 0
  22760. -2.3238 0.3432 -0.3383 H 0 0 0 0 0 0 0 0 0 0 0 0
  22761. -1.6631 -1.4350 1.2869 H 0 0 0 0 0 0 0 0 0 0 0 0
  22762. 2.3464 -0.7174 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0
  22763. 1.8678 1.0934 -0.9738 H 0 0 0 0 0 0 0 0 0 0 0 0
  22764. 1 2 2 0
  22765. 2 3 1 0
  22766. 3 4 2 0
  22767. 4 5 1 0
  22768. 5 6 2 0
  22769. 6 1 1 0
  22770. 1 7 1 0
  22771. 2 8 1 0
  22772. 3 9 1 0
  22773. 5 10 1 0
  22774. 6 11 1 0
  22775. M END
  22776. $$$$
  22777. RDKit 3D
  22778. 11 11 0 0 0 0 0 0 0 0999 V2000
  22779. -0.2702 0.8560 -0.7719 C 0 0 0 0 0 0 0 0 0 0 0 0
  22780. -1.2785 0.1377 -0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0
  22781. -0.9129 -0.8547 0.7576 C 0 0 0 0 0 0 0 0 0 0 0 0
  22782. 0.3682 -1.1664 1.0520 N 0 0 0 0 0 0 0 0 0 0 0 0
  22783. 1.3253 -0.4520 0.4208 C 0 0 0 0 0 0 0 0 0 0 0 0
  22784. 1.0589 0.5582 -0.4897 C 0 0 0 0 0 0 0 0 0 0 0 0
  22785. -0.5180 1.6412 -1.4802 H 0 0 0 0 0 0 0 0 0 0 0 0
  22786. -2.3238 0.3453 -0.3361 H 0 0 0 0 0 0 0 0 0 0 0 0
  22787. -1.6631 -1.4431 1.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
  22788. 2.3464 -0.7217 0.6744 H 0 0 0 0 0 0 0 0 0 0 0 0
  22789. 1.8678 1.0995 -0.9669 H 0 0 0 0 0 0 0 0 0 0 0 0
  22790. 1 2 2 0
  22791. 2 3 1 0
  22792. 3 4 2 0
  22793. 4 5 1 0
  22794. 5 6 2 0
  22795. 6 1 1 0
  22796. 1 7 1 0
  22797. 2 8 1 0
  22798. 3 9 1 0
  22799. 5 10 1 0
  22800. 6 11 1 0
  22801. M END
  22802. $$$$
  22803. RDKit 3D
  22804. 11 11 0 0 0 0 0 0 0 0999 V2000
  22805. -0.2702 0.8608 -0.7666 C 0 0 0 0 0 0 0 0 0 0 0 0
  22806. -1.2785 0.1385 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  22807. -0.9129 -0.8594 0.7523 C 0 0 0 0 0 0 0 0 0 0 0 0
  22808. 0.3682 -1.1730 1.0446 N 0 0 0 0 0 0 0 0 0 0 0 0
  22809. 1.3253 -0.4546 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0
  22810. 1.0589 0.5613 -0.4862 C 0 0 0 0 0 0 0 0 0 0 0 0
  22811. -0.5180 1.6505 -1.4698 H 0 0 0 0 0 0 0 0 0 0 0 0
  22812. -2.3238 0.3474 -0.3339 H 0 0 0 0 0 0 0 0 0 0 0 0
  22813. -1.6631 -1.4511 1.2688 H 0 0 0 0 0 0 0 0 0 0 0 0
  22814. 2.3464 -0.7259 0.6699 H 0 0 0 0 0 0 0 0 0 0 0 0
  22815. 1.8678 1.1055 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0
  22816. 1 2 2 0
  22817. 2 3 1 0
  22818. 3 4 2 0
  22819. 4 5 1 0
  22820. 5 6 2 0
  22821. 6 1 1 0
  22822. 1 7 1 0
  22823. 2 8 1 0
  22824. 3 9 1 0
  22825. 5 10 1 0
  22826. 6 11 1 0
  22827. M END
  22828. $$$$
  22829. RDKit 3D
  22830. 11 11 0 0 0 0 0 0 0 0999 V2000
  22831. -0.2702 0.8656 -0.7611 C 0 0 0 0 0 0 0 0 0 0 0 0
  22832. -1.2785 0.1394 -0.1362 C 0 0 0 0 0 0 0 0 0 0 0 0
  22833. -0.9129 -0.8641 0.7468 C 0 0 0 0 0 0 0 0 0 0 0 0
  22834. 0.3682 -1.1796 1.0372 N 0 0 0 0 0 0 0 0 0 0 0 0
  22835. 1.3253 -0.4573 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0
  22836. 1.0589 0.5643 -0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0
  22837. -0.5180 1.6597 -1.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
  22838. -2.3238 0.3495 -0.3317 H 0 0 0 0 0 0 0 0 0 0 0 0
  22839. -1.6631 -1.4590 1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0
  22840. 2.3464 -0.7301 0.6653 H 0 0 0 0 0 0 0 0 0 0 0 0
  22841. 1.8678 1.1115 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  22842. 1 2 2 0
  22843. 2 3 1 0
  22844. 3 4 2 0
  22845. 4 5 1 0
  22846. 5 6 2 0
  22847. 6 1 1 0
  22848. 1 7 1 0
  22849. 2 8 1 0
  22850. 3 9 1 0
  22851. 5 10 1 0
  22852. 6 11 1 0
  22853. M END
  22854. $$$$
  22855. RDKit 3D
  22856. 11 11 0 0 0 0 0 0 0 0999 V2000
  22857. -0.2702 0.8704 -0.7557 C 0 0 0 0 0 0 0 0 0 0 0 0
  22858. -1.2785 0.1402 -0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0
  22859. -0.9129 -0.8688 0.7414 C 0 0 0 0 0 0 0 0 0 0 0 0
  22860. 0.3682 -1.1861 1.0298 N 0 0 0 0 0 0 0 0 0 0 0 0
  22861. 1.3253 -0.4599 0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0
  22862. 1.0589 0.5673 -0.4791 C 0 0 0 0 0 0 0 0 0 0 0 0
  22863. -0.5180 1.6689 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
  22864. -2.3238 0.3516 -0.3295 H 0 0 0 0 0 0 0 0 0 0 0 0
  22865. -1.6631 -1.4669 1.2504 H 0 0 0 0 0 0 0 0 0 0 0 0
  22866. 2.3464 -0.7343 0.6607 H 0 0 0 0 0 0 0 0 0 0 0 0
  22867. 1.8678 1.1175 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0
  22868. 1 2 2 0
  22869. 2 3 1 0
  22870. 3 4 2 0
  22871. 4 5 1 0
  22872. 5 6 2 0
  22873. 6 1 1 0
  22874. 1 7 1 0
  22875. 2 8 1 0
  22876. 3 9 1 0
  22877. 5 10 1 0
  22878. 6 11 1 0
  22879. M END
  22880. $$$$
  22881. RDKit 3D
  22882. 11 11 0 0 0 0 0 0 0 0999 V2000
  22883. -0.2702 0.8751 -0.7502 C 0 0 0 0 0 0 0 0 0 0 0 0
  22884. -1.2785 0.1411 -0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0
  22885. -0.9129 -0.8735 0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0
  22886. 0.3682 -1.1925 1.0223 N 0 0 0 0 0 0 0 0 0 0 0 0
  22887. 1.3253 -0.4624 0.4093 C 0 0 0 0 0 0 0 0 0 0 0 0
  22888. 1.0589 0.5703 -0.4755 C 0 0 0 0 0 0 0 0 0 0 0 0
  22889. -0.5180 1.6779 -1.4384 H 0 0 0 0 0 0 0 0 0 0 0 0
  22890. -2.3238 0.3537 -0.3273 H 0 0 0 0 0 0 0 0 0 0 0 0
  22891. -1.6631 -1.4747 1.2412 H 0 0 0 0 0 0 0 0 0 0 0 0
  22892. 2.3464 -0.7384 0.6561 H 0 0 0 0 0 0 0 0 0 0 0 0
  22893. 1.8678 1.1234 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
  22894. 1 2 2 0
  22895. 2 3 1 0
  22896. 3 4 2 0
  22897. 4 5 1 0
  22898. 5 6 2 0
  22899. 6 1 1 0
  22900. 1 7 1 0
  22901. 2 8 1 0
  22902. 3 9 1 0
  22903. 5 10 1 0
  22904. 6 11 1 0
  22905. M END
  22906. $$$$
  22907. RDKit 3D
  22908. 11 11 0 0 0 0 0 0 0 0999 V2000
  22909. -0.2702 0.8798 -0.7447 C 0 0 0 0 0 0 0 0 0 0 0 0
  22910. -1.2785 0.1419 -0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
  22911. -0.9129 -0.8781 0.7304 C 0 0 0 0 0 0 0 0 0 0 0 0
  22912. 0.3682 -1.1989 1.0148 N 0 0 0 0 0 0 0 0 0 0 0 0
  22913. 1.3253 -0.4650 0.4064 C 0 0 0 0 0 0 0 0 0 0 0 0
  22914. 1.0589 0.5733 -0.4719 C 0 0 0 0 0 0 0 0 0 0 0 0
  22915. -0.5180 1.6869 -1.4279 H 0 0 0 0 0 0 0 0 0 0 0 0
  22916. -2.3238 0.3557 -0.3251 H 0 0 0 0 0 0 0 0 0 0 0 0
  22917. -1.6631 -1.4825 1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0
  22918. 2.3464 -0.7425 0.6514 H 0 0 0 0 0 0 0 0 0 0 0 0
  22919. 1.8678 1.1293 -0.9319 H 0 0 0 0 0 0 0 0 0 0 0 0
  22920. 1 2 2 0
  22921. 2 3 1 0
  22922. 3 4 2 0
  22923. 4 5 1 0
  22924. 5 6 2 0
  22925. 6 1 1 0
  22926. 1 7 1 0
  22927. 2 8 1 0
  22928. 3 9 1 0
  22929. 5 10 1 0
  22930. 6 11 1 0
  22931. M END
  22932. $$$$
  22933. RDKit 3D
  22934. 11 11 0 0 0 0 0 0 0 0999 V2000
  22935. -0.2702 0.8844 -0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0
  22936. -1.2785 0.1428 -0.1326 C 0 0 0 0 0 0 0 0 0 0 0 0
  22937. -0.9129 -0.8826 0.7249 C 0 0 0 0 0 0 0 0 0 0 0 0
  22938. 0.3682 -1.2053 1.0072 N 0 0 0 0 0 0 0 0 0 0 0 0
  22939. 1.3253 -0.4675 0.4035 C 0 0 0 0 0 0 0 0 0 0 0 0
  22940. 1.0589 0.5763 -0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0
  22941. -0.5180 1.6959 -1.4173 H 0 0 0 0 0 0 0 0 0 0 0 0
  22942. -2.3238 0.3578 -0.3228 H 0 0 0 0 0 0 0 0 0 0 0 0
  22943. -1.6631 -1.4902 1.2226 H 0 0 0 0 0 0 0 0 0 0 0 0
  22944. 2.3464 -0.7466 0.6468 H 0 0 0 0 0 0 0 0 0 0 0 0
  22945. 1.8678 1.1351 -0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0
  22946. 1 2 2 0
  22947. 2 3 1 0
  22948. 3 4 2 0
  22949. 4 5 1 0
  22950. 5 6 2 0
  22951. 6 1 1 0
  22952. 1 7 1 0
  22953. 2 8 1 0
  22954. 3 9 1 0
  22955. 5 10 1 0
  22956. 6 11 1 0
  22957. M END
  22958. $$$$
  22959. RDKit 3D
  22960. 11 11 0 0 0 0 0 0 0 0999 V2000
  22961. -0.2702 0.8891 -0.7336 C 0 0 0 0 0 0 0 0 0 0 0 0
  22962. -1.2785 0.1436 -0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0
  22963. -0.9129 -0.8872 0.7193 C 0 0 0 0 0 0 0 0 0 0 0 0
  22964. 0.3682 -1.2116 0.9997 N 0 0 0 0 0 0 0 0 0 0 0 0
  22965. 1.3253 -0.4701 0.4005 C 0 0 0 0 0 0 0 0 0 0 0 0
  22966. 1.0589 0.5792 -0.4647 C 0 0 0 0 0 0 0 0 0 0 0 0
  22967. -0.5180 1.7047 -1.4066 H 0 0 0 0 0 0 0 0 0 0 0 0
  22968. -2.3238 0.3598 -0.3206 H 0 0 0 0 0 0 0 0 0 0 0 0
  22969. -1.6631 -1.4979 1.2132 H 0 0 0 0 0 0 0 0 0 0 0 0
  22970. 2.3464 -0.7506 0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0
  22971. 1.8678 1.1409 -0.9176 H 0 0 0 0 0 0 0 0 0 0 0 0
  22972. 1 2 2 0
  22973. 2 3 1 0
  22974. 3 4 2 0
  22975. 4 5 1 0
  22976. 5 6 2 0
  22977. 6 1 1 0
  22978. 1 7 1 0
  22979. 2 8 1 0
  22980. 3 9 1 0
  22981. 5 10 1 0
  22982. 6 11 1 0
  22983. M END
  22984. $$$$
  22985. RDKit 3D
  22986. 11 11 0 0 0 0 0 0 0 0999 V2000
  22987. -0.2702 0.8937 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0
  22988. -1.2785 0.1444 -0.1308 C 0 0 0 0 0 0 0 0 0 0 0 0
  22989. -0.9129 -0.8917 0.7137 C 0 0 0 0 0 0 0 0 0 0 0 0
  22990. 0.3682 -1.2178 0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0
  22991. 1.3253 -0.4726 0.3976 C 0 0 0 0 0 0 0 0 0 0 0 0
  22992. 1.0589 0.5821 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0
  22993. -0.5180 1.7135 -1.3958 H 0 0 0 0 0 0 0 0 0 0 0 0
  22994. -2.3238 0.3618 -0.3183 H 0 0 0 0 0 0 0 0 0 0 0 0
  22995. -1.6631 -1.5055 1.2037 H 0 0 0 0 0 0 0 0 0 0 0 0
  22996. 2.3464 -0.7547 0.6373 H 0 0 0 0 0 0 0 0 0 0 0 0
  22997. 1.8678 1.1467 -0.9105 H 0 0 0 0 0 0 0 0 0 0 0 0
  22998. 1 2 2 0
  22999. 2 3 1 0
  23000. 3 4 2 0
  23001. 4 5 1 0
  23002. 5 6 2 0
  23003. 6 1 1 0
  23004. 1 7 1 0
  23005. 2 8 1 0
  23006. 3 9 1 0
  23007. 5 10 1 0
  23008. 6 11 1 0
  23009. M END
  23010. $$$$
  23011. RDKit 3D
  23012. 11 11 0 0 0 0 0 0 0 0999 V2000
  23013. -0.2702 0.8982 -0.7223 C 0 0 0 0 0 0 0 0 0 0 0 0
  23014. -1.2785 0.1452 -0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0
  23015. -0.9129 -0.8961 0.7081 C 0 0 0 0 0 0 0 0 0 0 0 0
  23016. 0.3682 -1.2240 0.9843 N 0 0 0 0 0 0 0 0 0 0 0 0
  23017. 1.3253 -0.4751 0.3946 C 0 0 0 0 0 0 0 0 0 0 0 0
  23018. 1.0589 0.5850 -0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0
  23019. -0.5180 1.7223 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0
  23020. -2.3238 0.3638 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
  23021. -1.6631 -1.5130 1.1943 H 0 0 0 0 0 0 0 0 0 0 0 0
  23022. 2.3464 -0.7587 0.6326 H 0 0 0 0 0 0 0 0 0 0 0 0
  23023. 1.8678 1.1524 -0.9032 H 0 0 0 0 0 0 0 0 0 0 0 0
  23024. 1 2 2 0
  23025. 2 3 1 0
  23026. 3 4 2 0
  23027. 4 5 1 0
  23028. 5 6 2 0
  23029. 6 1 1 0
  23030. 1 7 1 0
  23031. 2 8 1 0
  23032. 3 9 1 0
  23033. 5 10 1 0
  23034. 6 11 1 0
  23035. M END
  23036. $$$$
  23037. RDKit 3D
  23038. 11 11 0 0 0 0 0 0 0 0999 V2000
  23039. -0.2702 0.9027 -0.7167 C 0 0 0 0 0 0 0 0 0 0 0 0
  23040. -1.2785 0.1461 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0
  23041. -0.9129 -0.9006 0.7025 C 0 0 0 0 0 0 0 0 0 0 0 0
  23042. 0.3682 -1.2302 0.9766 N 0 0 0 0 0 0 0 0 0 0 0 0
  23043. 1.3253 -0.4775 0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0
  23044. 1.0589 0.5879 -0.4537 C 0 0 0 0 0 0 0 0 0 0 0 0
  23045. -0.5180 1.7309 -1.3742 H 0 0 0 0 0 0 0 0 0 0 0 0
  23046. -2.3238 0.3658 -0.3138 H 0 0 0 0 0 0 0 0 0 0 0 0
  23047. -1.6631 -1.5205 1.1847 H 0 0 0 0 0 0 0 0 0 0 0 0
  23048. 2.3464 -0.7626 0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0
  23049. 1.8678 1.1580 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  23050. 1 2 2 0
  23051. 2 3 1 0
  23052. 3 4 2 0
  23053. 4 5 1 0
  23054. 5 6 2 0
  23055. 6 1 1 0
  23056. 1 7 1 0
  23057. 2 8 1 0
  23058. 3 9 1 0
  23059. 5 10 1 0
  23060. 6 11 1 0
  23061. M END
  23062. $$$$
  23063. RDKit 3D
  23064. 11 11 0 0 0 0 0 0 0 0999 V2000
  23065. -0.2702 0.9072 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0
  23066. -1.2785 0.1469 -0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0
  23067. -0.9129 -0.9050 0.6968 C 0 0 0 0 0 0 0 0 0 0 0 0
  23068. 0.3682 -1.2363 0.9689 N 0 0 0 0 0 0 0 0 0 0 0 0
  23069. 1.3253 -0.4800 0.3886 C 0 0 0 0 0 0 0 0 0 0 0 0
  23070. 1.0589 0.5907 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0
  23071. -0.5180 1.7395 -1.3633 H 0 0 0 0 0 0 0 0 0 0 0 0
  23072. -2.3238 0.3677 -0.3115 H 0 0 0 0 0 0 0 0 0 0 0 0
  23073. -1.6631 -1.5279 1.1751 H 0 0 0 0 0 0 0 0 0 0 0 0
  23074. 2.3464 -0.7665 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0
  23075. 1.8678 1.1636 -0.8887 H 0 0 0 0 0 0 0 0 0 0 0 0
  23076. 1 2 2 0
  23077. 2 3 1 0
  23078. 3 4 2 0
  23079. 4 5 1 0
  23080. 5 6 2 0
  23081. 6 1 1 0
  23082. 1 7 1 0
  23083. 2 8 1 0
  23084. 3 9 1 0
  23085. 5 10 1 0
  23086. 6 11 1 0
  23087. M END
  23088. $$$$
  23089. RDKit 3D
  23090. 11 11 0 0 0 0 0 0 0 0999 V2000
  23091. -0.2702 0.9117 -0.7053 C 0 0 0 0 0 0 0 0 0 0 0 0
  23092. -1.2785 0.1477 -0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0
  23093. -0.9129 -0.9093 0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0
  23094. 0.3682 -1.2424 0.9611 N 0 0 0 0 0 0 0 0 0 0 0 0
  23095. 1.3253 -0.4824 0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0
  23096. 1.0589 0.5935 -0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0
  23097. -0.5180 1.7481 -1.3523 H 0 0 0 0 0 0 0 0 0 0 0 0
  23098. -2.3238 0.3697 -0.3091 H 0 0 0 0 0 0 0 0 0 0 0 0
  23099. -1.6631 -1.5352 1.1655 H 0 0 0 0 0 0 0 0 0 0 0 0
  23100. 2.3464 -0.7704 0.6182 H 0 0 0 0 0 0 0 0 0 0 0 0
  23101. 1.8678 1.1692 -0.8813 H 0 0 0 0 0 0 0 0 0 0 0 0
  23102. 1 2 2 0
  23103. 2 3 1 0
  23104. 3 4 2 0
  23105. 4 5 1 0
  23106. 5 6 2 0
  23107. 6 1 1 0
  23108. 1 7 1 0
  23109. 2 8 1 0
  23110. 3 9 1 0
  23111. 5 10 1 0
  23112. 6 11 1 0
  23113. M END
  23114. $$$$
  23115. RDKit 3D
  23116. 11 11 0 0 0 0 0 0 0 0999 V2000
  23117. -0.2702 0.9161 -0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0
  23118. -1.2785 0.1485 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0
  23119. -0.9129 -0.9137 0.6854 C 0 0 0 0 0 0 0 0 0 0 0 0
  23120. 0.3682 -1.2484 0.9533 N 0 0 0 0 0 0 0 0 0 0 0 0
  23121. 1.3253 -0.4848 0.3825 C 0 0 0 0 0 0 0 0 0 0 0 0
  23122. 1.0589 0.5963 -0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0
  23123. -0.5180 1.7565 -1.3413 H 0 0 0 0 0 0 0 0 0 0 0 0
  23124. -2.3238 0.3716 -0.3068 H 0 0 0 0 0 0 0 0 0 0 0 0
  23125. -1.6631 -1.5425 1.1559 H 0 0 0 0 0 0 0 0 0 0 0 0
  23126. 2.3464 -0.7743 0.6133 H 0 0 0 0 0 0 0 0 0 0 0 0
  23127. 1.8678 1.1747 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0
  23128. 1 2 2 0
  23129. 2 3 1 0
  23130. 3 4 2 0
  23131. 4 5 1 0
  23132. 5 6 2 0
  23133. 6 1 1 0
  23134. 1 7 1 0
  23135. 2 8 1 0
  23136. 3 9 1 0
  23137. 5 10 1 0
  23138. 6 11 1 0
  23139. M END
  23140. $$$$
  23141. RDKit 3D
  23142. 11 11 0 0 0 0 0 0 0 0999 V2000
  23143. -0.2702 0.9205 -0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0
  23144. -1.2785 0.1492 -0.1253 C 0 0 0 0 0 0 0 0 0 0 0 0
  23145. -0.9129 -0.9179 0.6796 C 0 0 0 0 0 0 0 0 0 0 0 0
  23146. 0.3682 -1.2543 0.9454 N 0 0 0 0 0 0 0 0 0 0 0 0
  23147. 1.3253 -0.4872 0.3795 C 0 0 0 0 0 0 0 0 0 0 0 0
  23148. 1.0589 0.5991 -0.4387 C 0 0 0 0 0 0 0 0 0 0 0 0
  23149. -0.5180 1.7649 -1.3303 H 0 0 0 0 0 0 0 0 0 0 0 0
  23150. -2.3238 0.3735 -0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0
  23151. -1.6631 -1.5498 1.1461 H 0 0 0 0 0 0 0 0 0 0 0 0
  23152. 2.3464 -0.7782 0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0
  23153. 1.8678 1.1802 -0.8666 H 0 0 0 0 0 0 0 0 0 0 0 0
  23154. 1 2 2 0
  23155. 2 3 1 0
  23156. 3 4 2 0
  23157. 4 5 1 0
  23158. 5 6 2 0
  23159. 6 1 1 0
  23160. 1 7 1 0
  23161. 2 8 1 0
  23162. 3 9 1 0
  23163. 5 10 1 0
  23164. 6 11 1 0
  23165. M END
  23166. $$$$
  23167. RDKit 3D
  23168. 11 11 0 0 0 0 0 0 0 0999 V2000
  23169. -0.2702 0.9248 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
  23170. -1.2785 0.1500 -0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0
  23171. -0.9129 -0.9222 0.6738 C 0 0 0 0 0 0 0 0 0 0 0 0
  23172. 0.3682 -1.2603 0.9375 N 0 0 0 0 0 0 0 0 0 0 0 0
  23173. 1.3253 -0.4896 0.3764 C 0 0 0 0 0 0 0 0 0 0 0 0
  23174. 1.0589 0.6018 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0
  23175. -0.5180 1.7733 -1.3191 H 0 0 0 0 0 0 0 0 0 0 0 0
  23176. -2.3238 0.3754 -0.3021 H 0 0 0 0 0 0 0 0 0 0 0 0
  23177. -1.6631 -1.5569 1.1364 H 0 0 0 0 0 0 0 0 0 0 0 0
  23178. 2.3464 -0.7820 0.6035 H 0 0 0 0 0 0 0 0 0 0 0 0
  23179. 1.8678 1.1856 -0.8592 H 0 0 0 0 0 0 0 0 0 0 0 0
  23180. 1 2 2 0
  23181. 2 3 1 0
  23182. 3 4 2 0
  23183. 4 5 1 0
  23184. 5 6 2 0
  23185. 6 1 1 0
  23186. 1 7 1 0
  23187. 2 8 1 0
  23188. 3 9 1 0
  23189. 5 10 1 0
  23190. 6 11 1 0
  23191. M END
  23192. $$$$
  23193. RDKit 3D
  23194. 11 11 0 0 0 0 0 0 0 0999 V2000
  23195. -0.2702 0.9291 -0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0
  23196. -1.2785 0.1508 -0.1234 C 0 0 0 0 0 0 0 0 0 0 0 0
  23197. -0.9129 -0.9264 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0
  23198. 0.3682 -1.2661 0.9296 N 0 0 0 0 0 0 0 0 0 0 0 0
  23199. 1.3253 -0.4920 0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0
  23200. 1.0589 0.6045 -0.4312 C 0 0 0 0 0 0 0 0 0 0 0 0
  23201. -0.5180 1.7815 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0
  23202. -2.3238 0.3773 -0.2997 H 0 0 0 0 0 0 0 0 0 0 0 0
  23203. -1.6631 -1.5640 1.1266 H 0 0 0 0 0 0 0 0 0 0 0 0
  23204. 2.3464 -0.7857 0.5986 H 0 0 0 0 0 0 0 0 0 0 0 0
  23205. 1.8678 1.1910 -0.8517 H 0 0 0 0 0 0 0 0 0 0 0 0
  23206. 1 2 2 0
  23207. 2 3 1 0
  23208. 3 4 2 0
  23209. 4 5 1 0
  23210. 5 6 2 0
  23211. 6 1 1 0
  23212. 1 7 1 0
  23213. 2 8 1 0
  23214. 3 9 1 0
  23215. 5 10 1 0
  23216. 6 11 1 0
  23217. M END
  23218. $$$$
  23219. RDKit 3D
  23220. 11 11 0 0 0 0 0 0 0 0999 V2000
  23221. -0.2702 0.9334 -0.6763 C 0 0 0 0 0 0 0 0 0 0 0 0
  23222. -1.2785 0.1516 -0.1224 C 0 0 0 0 0 0 0 0 0 0 0 0
  23223. -0.9129 -0.9306 0.6622 C 0 0 0 0 0 0 0 0 0 0 0 0
  23224. 0.3682 -1.2719 0.9216 N 0 0 0 0 0 0 0 0 0 0 0 0
  23225. 1.3253 -0.4943 0.3702 C 0 0 0 0 0 0 0 0 0 0 0 0
  23226. 1.0589 0.6072 -0.4274 C 0 0 0 0 0 0 0 0 0 0 0 0
  23227. -0.5180 1.7897 -1.2968 H 0 0 0 0 0 0 0 0 0 0 0 0
  23228. -2.3238 0.3792 -0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0
  23229. -1.6631 -1.5711 1.1167 H 0 0 0 0 0 0 0 0 0 0 0 0
  23230. 2.3464 -0.7895 0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0
  23231. 1.8678 1.1963 -0.8442 H 0 0 0 0 0 0 0 0 0 0 0 0
  23232. 1 2 2 0
  23233. 2 3 1 0
  23234. 3 4 2 0
  23235. 4 5 1 0
  23236. 5 6 2 0
  23237. 6 1 1 0
  23238. 1 7 1 0
  23239. 2 8 1 0
  23240. 3 9 1 0
  23241. 5 10 1 0
  23242. 6 11 1 0
  23243. M END
  23244. $$$$
  23245. RDKit 3D
  23246. 11 11 0 0 0 0 0 0 0 0999 V2000
  23247. -0.2702 0.9376 -0.6704 C 0 0 0 0 0 0 0 0 0 0 0 0
  23248. -1.2785 0.1523 -0.1215 C 0 0 0 0 0 0 0 0 0 0 0 0
  23249. -0.9129 -0.9347 0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0
  23250. 0.3682 -1.2777 0.9136 N 0 0 0 0 0 0 0 0 0 0 0 0
  23251. 1.3253 -0.4966 0.3671 C 0 0 0 0 0 0 0 0 0 0 0 0
  23252. 1.0589 0.6099 -0.4235 C 0 0 0 0 0 0 0 0 0 0 0 0
  23253. -0.5180 1.7978 -1.2855 H 0 0 0 0 0 0 0 0 0 0 0 0
  23254. -2.3238 0.3811 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  23255. -1.6631 -1.5781 1.1068 H 0 0 0 0 0 0 0 0 0 0 0 0
  23256. 2.3464 -0.7932 0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0
  23257. 1.8678 1.2016 -0.8367 H 0 0 0 0 0 0 0 0 0 0 0 0
  23258. 1 2 2 0
  23259. 2 3 1 0
  23260. 3 4 2 0
  23261. 4 5 1 0
  23262. 5 6 2 0
  23263. 6 1 1 0
  23264. 1 7 1 0
  23265. 2 8 1 0
  23266. 3 9 1 0
  23267. 5 10 1 0
  23268. 6 11 1 0
  23269. M END
  23270. $$$$
  23271. RDKit 3D
  23272. 11 11 0 0 0 0 0 0 0 0999 V2000
  23273. -0.2702 0.9418 -0.6645 C 0 0 0 0 0 0 0 0 0 0 0 0
  23274. -1.2785 0.1531 -0.1205 C 0 0 0 0 0 0 0 0 0 0 0 0
  23275. -0.9129 -0.9388 0.6505 C 0 0 0 0 0 0 0 0 0 0 0 0
  23276. 0.3682 -1.2834 0.9055 N 0 0 0 0 0 0 0 0 0 0 0 0
  23277. 1.3253 -0.4989 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
  23278. 1.0589 0.6126 -0.4197 C 0 0 0 0 0 0 0 0 0 0 0 0
  23279. -0.5180 1.8058 -1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0
  23280. -2.3238 0.3829 -0.2926 H 0 0 0 0 0 0 0 0 0 0 0 0
  23281. -1.6631 -1.5850 1.0969 H 0 0 0 0 0 0 0 0 0 0 0 0
  23282. 2.3464 -0.7969 0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0
  23283. 1.8678 1.2068 -0.8291 H 0 0 0 0 0 0 0 0 0 0 0 0
  23284. 1 2 2 0
  23285. 2 3 1 0
  23286. 3 4 2 0
  23287. 4 5 1 0
  23288. 5 6 2 0
  23289. 6 1 1 0
  23290. 1 7 1 0
  23291. 2 8 1 0
  23292. 3 9 1 0
  23293. 5 10 1 0
  23294. 6 11 1 0
  23295. M END
  23296. $$$$
  23297. RDKit 3D
  23298. 11 11 0 0 0 0 0 0 0 0999 V2000
  23299. -0.2702 0.9460 -0.6586 C 0 0 0 0 0 0 0 0 0 0 0 0
  23300. -1.2785 0.1539 -0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0
  23301. -0.9129 -0.9429 0.6445 C 0 0 0 0 0 0 0 0 0 0 0 0
  23302. 0.3682 -1.2891 0.8975 N 0 0 0 0 0 0 0 0 0 0 0 0
  23303. 1.3253 -0.5012 0.3608 C 0 0 0 0 0 0 0 0 0 0 0 0
  23304. 1.0589 0.6152 -0.4158 C 0 0 0 0 0 0 0 0 0 0 0 0
  23305. -0.5180 1.8138 -1.2628 H 0 0 0 0 0 0 0 0 0 0 0 0
  23306. -2.3238 0.3847 -0.2902 H 0 0 0 0 0 0 0 0 0 0 0 0
  23307. -1.6631 -1.5919 1.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
  23308. 2.3464 -0.8005 0.5787 H 0 0 0 0 0 0 0 0 0 0 0 0
  23309. 1.8678 1.2120 -0.8215 H 0 0 0 0 0 0 0 0 0 0 0 0
  23310. 1 2 2 0
  23311. 2 3 1 0
  23312. 3 4 2 0
  23313. 4 5 1 0
  23314. 5 6 2 0
  23315. 6 1 1 0
  23316. 1 7 1 0
  23317. 2 8 1 0
  23318. 3 9 1 0
  23319. 5 10 1 0
  23320. 6 11 1 0
  23321. M END
  23322. $$$$
  23323. RDKit 3D
  23324. 11 11 0 0 0 0 0 0 0 0999 V2000
  23325. -0.2702 0.9501 -0.6526 C 0 0 0 0 0 0 0 0 0 0 0 0
  23326. -1.2785 0.1546 -0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0
  23327. -0.9129 -0.9469 0.6386 C 0 0 0 0 0 0 0 0 0 0 0 0
  23328. 0.3682 -1.2947 0.8893 N 0 0 0 0 0 0 0 0 0 0 0 0
  23329. 1.3253 -0.5034 0.3577 C 0 0 0 0 0 0 0 0 0 0 0 0
  23330. 1.0589 0.6178 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0
  23331. -0.5180 1.8217 -1.2514 H 0 0 0 0 0 0 0 0 0 0 0 0
  23332. -2.3238 0.3866 -0.2877 H 0 0 0 0 0 0 0 0 0 0 0 0
  23333. -1.6631 -1.5987 1.0769 H 0 0 0 0 0 0 0 0 0 0 0 0
  23334. 2.3464 -0.8042 0.5736 H 0 0 0 0 0 0 0 0 0 0 0 0
  23335. 1.8678 1.2171 -0.8139 H 0 0 0 0 0 0 0 0 0 0 0 0
  23336. 1 2 2 0
  23337. 2 3 1 0
  23338. 3 4 2 0
  23339. 4 5 1 0
  23340. 5 6 2 0
  23341. 6 1 1 0
  23342. 1 7 1 0
  23343. 2 8 1 0
  23344. 3 9 1 0
  23345. 5 10 1 0
  23346. 6 11 1 0
  23347. M END
  23348. $$$$
  23349. RDKit 3D
  23350. 11 11 0 0 0 0 0 0 0 0999 V2000
  23351. -0.2702 0.9542 -0.6466 C 0 0 0 0 0 0 0 0 0 0 0 0
  23352. -1.2785 0.1554 -0.1176 C 0 0 0 0 0 0 0 0 0 0 0 0
  23353. -0.9129 -0.9509 0.6326 C 0 0 0 0 0 0 0 0 0 0 0 0
  23354. 0.3682 -1.3003 0.8812 N 0 0 0 0 0 0 0 0 0 0 0 0
  23355. 1.3253 -0.5057 0.3545 C 0 0 0 0 0 0 0 0 0 0 0 0
  23356. 1.0589 0.6204 -0.4081 C 0 0 0 0 0 0 0 0 0 0 0 0
  23357. -0.5180 1.8295 -1.2399 H 0 0 0 0 0 0 0 0 0 0 0 0
  23358. -2.3238 0.3884 -0.2853 H 0 0 0 0 0 0 0 0 0 0 0 0
  23359. -1.6631 -1.6054 1.0668 H 0 0 0 0 0 0 0 0 0 0 0 0
  23360. 2.3464 -0.8077 0.5686 H 0 0 0 0 0 0 0 0 0 0 0 0
  23361. 1.8678 1.2222 -0.8062 H 0 0 0 0 0 0 0 0 0 0 0 0
  23362. 1 2 2 0
  23363. 2 3 1 0
  23364. 3 4 2 0
  23365. 4 5 1 0
  23366. 5 6 2 0
  23367. 6 1 1 0
  23368. 1 7 1 0
  23369. 2 8 1 0
  23370. 3 9 1 0
  23371. 5 10 1 0
  23372. 6 11 1 0
  23373. M END
  23374. $$$$
  23375. RDKit 3D
  23376. 11 11 0 0 0 0 0 0 0 0999 V2000
  23377. -0.2702 0.9582 -0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0
  23378. -1.2785 0.1561 -0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0
  23379. -0.9129 -0.9549 0.6267 C 0 0 0 0 0 0 0 0 0 0 0 0
  23380. 0.3682 -1.3058 0.8730 N 0 0 0 0 0 0 0 0 0 0 0 0
  23381. 1.3253 -0.5079 0.3513 C 0 0 0 0 0 0 0 0 0 0 0 0
  23382. 1.0589 0.6229 -0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0
  23383. -0.5180 1.8373 -1.2284 H 0 0 0 0 0 0 0 0 0 0 0 0
  23384. -2.3238 0.3901 -0.2829 H 0 0 0 0 0 0 0 0 0 0 0 0
  23385. -1.6631 -1.6121 1.0567 H 0 0 0 0 0 0 0 0 0 0 0 0
  23386. 2.3464 -0.8113 0.5635 H 0 0 0 0 0 0 0 0 0 0 0 0
  23387. 1.8678 1.2273 -0.7985 H 0 0 0 0 0 0 0 0 0 0 0 0
  23388. 1 2 2 0
  23389. 2 3 1 0
  23390. 3 4 2 0
  23391. 4 5 1 0
  23392. 5 6 2 0
  23393. 6 1 1 0
  23394. 1 7 1 0
  23395. 2 8 1 0
  23396. 3 9 1 0
  23397. 5 10 1 0
  23398. 6 11 1 0
  23399. M END
  23400. $$$$
  23401. RDKit 3D
  23402. 11 11 0 0 0 0 0 0 0 0999 V2000
  23403. -0.2702 0.9622 -0.6346 C 0 0 0 0 0 0 0 0 0 0 0 0
  23404. -1.2785 0.1568 -0.1157 C 0 0 0 0 0 0 0 0 0 0 0 0
  23405. -0.9129 -0.9588 0.6206 C 0 0 0 0 0 0 0 0 0 0 0 0
  23406. 0.3682 -1.3112 0.8648 N 0 0 0 0 0 0 0 0 0 0 0 0
  23407. 1.3253 -0.5101 0.3481 C 0 0 0 0 0 0 0 0 0 0 0 0
  23408. 1.0589 0.6254 -0.4003 C 0 0 0 0 0 0 0 0 0 0 0 0
  23409. -0.5180 1.8450 -1.2168 H 0 0 0 0 0 0 0 0 0 0 0 0
  23410. -2.3238 0.3919 -0.2804 H 0 0 0 0 0 0 0 0 0 0 0 0
  23411. -1.6631 -1.6187 1.0466 H 0 0 0 0 0 0 0 0 0 0 0 0
  23412. 2.3464 -0.8148 0.5584 H 0 0 0 0 0 0 0 0 0 0 0 0
  23413. 1.8678 1.2323 -0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0
  23414. 1 2 2 0
  23415. 2 3 1 0
  23416. 3 4 2 0
  23417. 4 5 1 0
  23418. 5 6 2 0
  23419. 6 1 1 0
  23420. 1 7 1 0
  23421. 2 8 1 0
  23422. 3 9 1 0
  23423. 5 10 1 0
  23424. 6 11 1 0
  23425. M END
  23426. $$$$
  23427. RDKit 3D
  23428. 11 11 0 0 0 0 0 0 0 0999 V2000
  23429. -0.2702 0.9662 -0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0
  23430. -1.2785 0.1575 -0.1147 C 0 0 0 0 0 0 0 0 0 0 0 0
  23431. -0.9129 -0.9627 0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0
  23432. 0.3682 -1.3166 0.8565 N 0 0 0 0 0 0 0 0 0 0 0 0
  23433. 1.3253 -0.5123 0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0
  23434. 1.0589 0.6279 -0.3963 C 0 0 0 0 0 0 0 0 0 0 0 0
  23435. -0.5180 1.8526 -1.2052 H 0 0 0 0 0 0 0 0 0 0 0 0
  23436. -2.3238 0.3937 -0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
  23437. -1.6631 -1.6252 1.0364 H 0 0 0 0 0 0 0 0 0 0 0 0
  23438. 2.3464 -0.8183 0.5532 H 0 0 0 0 0 0 0 0 0 0 0 0
  23439. 1.8678 1.2372 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0
  23440. 1 2 2 0
  23441. 2 3 1 0
  23442. 3 4 2 0
  23443. 4 5 1 0
  23444. 5 6 2 0
  23445. 6 1 1 0
  23446. 1 7 1 0
  23447. 2 8 1 0
  23448. 3 9 1 0
  23449. 5 10 1 0
  23450. 6 11 1 0
  23451. M END
  23452. $$$$
  23453. RDKit 3D
  23454. 11 11 0 0 0 0 0 0 0 0999 V2000
  23455. -0.2702 0.9701 -0.6225 C 0 0 0 0 0 0 0 0 0 0 0 0
  23456. -1.2785 0.1583 -0.1137 C 0 0 0 0 0 0 0 0 0 0 0 0
  23457. -0.9129 -0.9665 0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0
  23458. 0.3682 -1.3220 0.8482 N 0 0 0 0 0 0 0 0 0 0 0 0
  23459. 1.3253 -0.5144 0.3417 C 0 0 0 0 0 0 0 0 0 0 0 0
  23460. 1.0589 0.6304 -0.3924 C 0 0 0 0 0 0 0 0 0 0 0 0
  23461. -0.5180 1.8601 -1.1935 H 0 0 0 0 0 0 0 0 0 0 0 0
  23462. -2.3238 0.3954 -0.2755 H 0 0 0 0 0 0 0 0 0 0 0 0
  23463. -1.6631 -1.6317 1.0261 H 0 0 0 0 0 0 0 0 0 0 0 0
  23464. 2.3464 -0.8218 0.5481 H 0 0 0 0 0 0 0 0 0 0 0 0
  23465. 1.8678 1.2421 -0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0
  23466. 1 2 2 0
  23467. 2 3 1 0
  23468. 3 4 2 0
  23469. 4 5 1 0
  23470. 5 6 2 0
  23471. 6 1 1 0
  23472. 1 7 1 0
  23473. 2 8 1 0
  23474. 3 9 1 0
  23475. 5 10 1 0
  23476. 6 11 1 0
  23477. M END
  23478. $$$$
  23479. RDKit 3D
  23480. 11 11 0 0 0 0 0 0 0 0999 V2000
  23481. -0.2702 0.9740 -0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0
  23482. -1.2785 0.1590 -0.1127 C 0 0 0 0 0 0 0 0 0 0 0 0
  23483. -0.9129 -0.9703 0.6025 C 0 0 0 0 0 0 0 0 0 0 0 0
  23484. 0.3682 -1.3273 0.8399 N 0 0 0 0 0 0 0 0 0 0 0 0
  23485. 1.3253 -0.5166 0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0
  23486. 1.0589 0.6329 -0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0
  23487. -0.5180 1.8676 -1.1818 H 0 0 0 0 0 0 0 0 0 0 0 0
  23488. -2.3238 0.3971 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0
  23489. -1.6631 -1.6381 1.0159 H 0 0 0 0 0 0 0 0 0 0 0 0
  23490. 2.3464 -0.8252 0.5429 H 0 0 0 0 0 0 0 0 0 0 0 0
  23491. 1.8678 1.2469 -0.7674 H 0 0 0 0 0 0 0 0 0 0 0 0
  23492. 1 2 2 0
  23493. 2 3 1 0
  23494. 3 4 2 0
  23495. 4 5 1 0
  23496. 5 6 2 0
  23497. 6 1 1 0
  23498. 1 7 1 0
  23499. 2 8 1 0
  23500. 3 9 1 0
  23501. 5 10 1 0
  23502. 6 11 1 0
  23503. M END
  23504. $$$$
  23505. RDKit 3D
  23506. 11 11 0 0 0 0 0 0 0 0999 V2000
  23507. -0.2702 0.9779 -0.6102 C 0 0 0 0 0 0 0 0 0 0 0 0
  23508. -1.2785 0.1597 -0.1117 C 0 0 0 0 0 0 0 0 0 0 0 0
  23509. -0.9129 -0.9741 0.5964 C 0 0 0 0 0 0 0 0 0 0 0 0
  23510. 0.3682 -1.3325 0.8316 N 0 0 0 0 0 0 0 0 0 0 0 0
  23511. 1.3253 -0.5187 0.3352 C 0 0 0 0 0 0 0 0 0 0 0 0
  23512. 1.0589 0.6353 -0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0
  23513. -0.5180 1.8750 -1.1701 H 0 0 0 0 0 0 0 0 0 0 0 0
  23514. -2.3238 0.3988 -0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0
  23515. -1.6631 -1.6445 1.0056 H 0 0 0 0 0 0 0 0 0 0 0 0
  23516. 2.3464 -0.8286 0.5377 H 0 0 0 0 0 0 0 0 0 0 0 0
  23517. 1.8678 1.2517 -0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0
  23518. 1 2 2 0
  23519. 2 3 1 0
  23520. 3 4 2 0
  23521. 4 5 1 0
  23522. 5 6 2 0
  23523. 6 1 1 0
  23524. 1 7 1 0
  23525. 2 8 1 0
  23526. 3 9 1 0
  23527. 5 10 1 0
  23528. 6 11 1 0
  23529. M END
  23530. $$$$
  23531. RDKit 3D
  23532. 11 11 0 0 0 0 0 0 0 0999 V2000
  23533. -0.2702 0.9817 -0.6041 C 0 0 0 0 0 0 0 0 0 0 0 0
  23534. -1.2785 0.1604 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
  23535. -0.9129 -0.9778 0.5902 C 0 0 0 0 0 0 0 0 0 0 0 0
  23536. 0.3682 -1.3377 0.8232 N 0 0 0 0 0 0 0 0 0 0 0 0
  23537. 1.3253 -0.5208 0.3319 C 0 0 0 0 0 0 0 0 0 0 0 0
  23538. 1.0589 0.6377 -0.3804 C 0 0 0 0 0 0 0 0 0 0 0 0
  23539. -0.5180 1.8823 -1.1583 H 0 0 0 0 0 0 0 0 0 0 0 0
  23540. -2.3238 0.4005 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0
  23541. -1.6631 -1.6507 0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0
  23542. 2.3464 -0.8320 0.5325 H 0 0 0 0 0 0 0 0 0 0 0 0
  23543. 1.8678 1.2565 -0.7517 H 0 0 0 0 0 0 0 0 0 0 0 0
  23544. 1 2 2 0
  23545. 2 3 1 0
  23546. 3 4 2 0
  23547. 4 5 1 0
  23548. 5 6 2 0
  23549. 6 1 1 0
  23550. 1 7 1 0
  23551. 2 8 1 0
  23552. 3 9 1 0
  23553. 5 10 1 0
  23554. 6 11 1 0
  23555. M END
  23556. $$$$
  23557. RDKit 3D
  23558. 11 11 0 0 0 0 0 0 0 0999 V2000
  23559. -0.2702 0.9855 -0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0
  23560. -1.2785 0.1611 -0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0
  23561. -0.9129 -0.9815 0.5841 C 0 0 0 0 0 0 0 0 0 0 0 0
  23562. 0.3682 -1.3429 0.8148 N 0 0 0 0 0 0 0 0 0 0 0 0
  23563. 1.3253 -0.5228 0.3287 C 0 0 0 0 0 0 0 0 0 0 0 0
  23564. 1.0589 0.6401 -0.3764 C 0 0 0 0 0 0 0 0 0 0 0 0
  23565. -0.5180 1.8895 -1.1464 H 0 0 0 0 0 0 0 0 0 0 0 0
  23566. -2.3238 0.4022 -0.2654 H 0 0 0 0 0 0 0 0 0 0 0 0
  23567. -1.6631 -1.6570 0.9848 H 0 0 0 0 0 0 0 0 0 0 0 0
  23568. 2.3464 -0.8353 0.5273 H 0 0 0 0 0 0 0 0 0 0 0 0
  23569. 1.8678 1.2612 -0.7438 H 0 0 0 0 0 0 0 0 0 0 0 0
  23570. 1 2 2 0
  23571. 2 3 1 0
  23572. 3 4 2 0
  23573. 4 5 1 0
  23574. 5 6 2 0
  23575. 6 1 1 0
  23576. 1 7 1 0
  23577. 2 8 1 0
  23578. 3 9 1 0
  23579. 5 10 1 0
  23580. 6 11 1 0
  23581. M END
  23582. $$$$
  23583. RDKit 3D
  23584. 11 11 0 0 0 0 0 0 0 0999 V2000
  23585. -0.2702 0.9892 -0.5917 C 0 0 0 0 0 0 0 0 0 0 0 0
  23586. -1.2785 0.1618 -0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0
  23587. -0.9129 -0.9852 0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0
  23588. 0.3682 -1.3480 0.8063 N 0 0 0 0 0 0 0 0 0 0 0 0
  23589. 1.3253 -0.5249 0.3254 C 0 0 0 0 0 0 0 0 0 0 0 0
  23590. 1.0589 0.6424 -0.3724 C 0 0 0 0 0 0 0 0 0 0 0 0
  23591. -0.5180 1.8967 -1.1345 H 0 0 0 0 0 0 0 0 0 0 0 0
  23592. -2.3238 0.4039 -0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0
  23593. -1.6631 -1.6631 0.9744 H 0 0 0 0 0 0 0 0 0 0 0 0
  23594. 2.3464 -0.8386 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  23595. 1.8678 1.2658 -0.7358 H 0 0 0 0 0 0 0 0 0 0 0 0
  23596. 1 2 2 0
  23597. 2 3 1 0
  23598. 3 4 2 0
  23599. 4 5 1 0
  23600. 5 6 2 0
  23601. 6 1 1 0
  23602. 1 7 1 0
  23603. 2 8 1 0
  23604. 3 9 1 0
  23605. 5 10 1 0
  23606. 6 11 1 0
  23607. M END
  23608. $$$$
  23609. RDKit 3D
  23610. 11 11 0 0 0 0 0 0 0 0999 V2000
  23611. -0.2702 0.9929 -0.5855 C 0 0 0 0 0 0 0 0 0 0 0 0
  23612. -1.2785 0.1624 -0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0
  23613. -0.9129 -0.9888 0.5717 C 0 0 0 0 0 0 0 0 0 0 0 0
  23614. 0.3682 -1.3530 0.7978 N 0 0 0 0 0 0 0 0 0 0 0 0
  23615. 1.3253 -0.5269 0.3221 C 0 0 0 0 0 0 0 0 0 0 0 0
  23616. 1.0589 0.6448 -0.3683 C 0 0 0 0 0 0 0 0 0 0 0 0
  23617. -0.5180 1.9038 -1.1226 H 0 0 0 0 0 0 0 0 0 0 0 0
  23618. -2.3238 0.4055 -0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0
  23619. -1.6631 -1.6692 0.9639 H 0 0 0 0 0 0 0 0 0 0 0 0
  23620. 2.3464 -0.8418 0.5167 H 0 0 0 0 0 0 0 0 0 0 0 0
  23621. 1.8678 1.2704 -0.7279 H 0 0 0 0 0 0 0 0 0 0 0 0
  23622. 1 2 2 0
  23623. 2 3 1 0
  23624. 3 4 2 0
  23625. 4 5 1 0
  23626. 5 6 2 0
  23627. 6 1 1 0
  23628. 1 7 1 0
  23629. 2 8 1 0
  23630. 3 9 1 0
  23631. 5 10 1 0
  23632. 6 11 1 0
  23633. M END
  23634. $$$$
  23635. RDKit 3D
  23636. 11 11 0 0 0 0 0 0 0 0999 V2000
  23637. -0.2702 0.9965 -0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0
  23638. -1.2785 0.1631 -0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0
  23639. -0.9129 -0.9924 0.5655 C 0 0 0 0 0 0 0 0 0 0 0 0
  23640. 0.3682 -1.3580 0.7893 N 0 0 0 0 0 0 0 0 0 0 0 0
  23641. 1.3253 -0.5289 0.3187 C 0 0 0 0 0 0 0 0 0 0 0 0
  23642. 1.0589 0.6471 -0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0
  23643. -0.5180 1.9108 -1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0
  23644. -2.3238 0.4071 -0.2578 H 0 0 0 0 0 0 0 0 0 0 0 0
  23645. -1.6631 -1.6752 0.9534 H 0 0 0 0 0 0 0 0 0 0 0 0
  23646. 2.3464 -0.8451 0.5114 H 0 0 0 0 0 0 0 0 0 0 0 0
  23647. 1.8678 1.2750 -0.7199 H 0 0 0 0 0 0 0 0 0 0 0 0
  23648. 1 2 2 0
  23649. 2 3 1 0
  23650. 3 4 2 0
  23651. 4 5 1 0
  23652. 5 6 2 0
  23653. 6 1 1 0
  23654. 1 7 1 0
  23655. 2 8 1 0
  23656. 3 9 1 0
  23657. 5 10 1 0
  23658. 6 11 1 0
  23659. M END
  23660. $$$$
  23661. RDKit 3D
  23662. 11 11 0 0 0 0 0 0 0 0999 V2000
  23663. -0.2702 1.0002 -0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0
  23664. -1.2785 0.1638 -0.1056 C 0 0 0 0 0 0 0 0 0 0 0 0
  23665. -0.9129 -0.9959 0.5592 C 0 0 0 0 0 0 0 0 0 0 0 0
  23666. 0.3682 -1.3629 0.7807 N 0 0 0 0 0 0 0 0 0 0 0 0
  23667. 1.3253 -0.5309 0.3154 C 0 0 0 0 0 0 0 0 0 0 0 0
  23668. 1.0589 0.6493 -0.3602 C 0 0 0 0 0 0 0 0 0 0 0 0
  23669. -0.5180 1.9177 -1.0986 H 0 0 0 0 0 0 0 0 0 0 0 0
  23670. -2.3238 0.4088 -0.2552 H 0 0 0 0 0 0 0 0 0 0 0 0
  23671. -1.6631 -1.6812 0.9429 H 0 0 0 0 0 0 0 0 0 0 0 0
  23672. 2.3464 -0.8483 0.5061 H 0 0 0 0 0 0 0 0 0 0 0 0
  23673. 1.8678 1.2795 -0.7118 H 0 0 0 0 0 0 0 0 0 0 0 0
  23674. 1 2 2 0
  23675. 2 3 1 0
  23676. 3 4 2 0
  23677. 4 5 1 0
  23678. 5 6 2 0
  23679. 6 1 1 0
  23680. 1 7 1 0
  23681. 2 8 1 0
  23682. 3 9 1 0
  23683. 5 10 1 0
  23684. 6 11 1 0
  23685. M END
  23686. $$$$
  23687. RDKit 3D
  23688. 11 11 0 0 0 0 0 0 0 0999 V2000
  23689. -0.2702 1.0037 -0.5666 C 0 0 0 0 0 0 0 0 0 0 0 0
  23690. -1.2785 0.1644 -0.1045 C 0 0 0 0 0 0 0 0 0 0 0 0
  23691. -0.9129 -0.9994 0.5529 C 0 0 0 0 0 0 0 0 0 0 0 0
  23692. 0.3682 -1.3678 0.7722 N 0 0 0 0 0 0 0 0 0 0 0 0
  23693. 1.3253 -0.5329 0.3121 C 0 0 0 0 0 0 0 0 0 0 0 0
  23694. 1.0589 0.6516 -0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0
  23695. -0.5180 1.9246 -1.0865 H 0 0 0 0 0 0 0 0 0 0 0 0
  23696. -2.3238 0.4103 -0.2527 H 0 0 0 0 0 0 0 0 0 0 0 0
  23697. -1.6631 -1.6871 0.9323 H 0 0 0 0 0 0 0 0 0 0 0 0
  23698. 2.3464 -0.8514 0.5008 H 0 0 0 0 0 0 0 0 0 0 0 0
  23699. 1.8678 1.2839 -0.7038 H 0 0 0 0 0 0 0 0 0 0 0 0
  23700. 1 2 2 0
  23701. 2 3 1 0
  23702. 3 4 2 0
  23703. 4 5 1 0
  23704. 5 6 2 0
  23705. 6 1 1 0
  23706. 1 7 1 0
  23707. 2 8 1 0
  23708. 3 9 1 0
  23709. 5 10 1 0
  23710. 6 11 1 0
  23711. M END
  23712. $$$$
  23713. RDKit 3D
  23714. 11 11 0 0 0 0 0 0 0 0999 V2000
  23715. -0.2702 1.0073 -0.5603 C 0 0 0 0 0 0 0 0 0 0 0 0
  23716. -1.2785 0.1651 -0.1035 C 0 0 0 0 0 0 0 0 0 0 0 0
  23717. -0.9129 -1.0028 0.5467 C 0 0 0 0 0 0 0 0 0 0 0 0
  23718. 0.3682 -1.3726 0.7636 N 0 0 0 0 0 0 0 0 0 0 0 0
  23719. 1.3253 -0.5349 0.3087 C 0 0 0 0 0 0 0 0 0 0 0 0
  23720. 1.0589 0.6538 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0
  23721. -0.5180 1.9314 -1.0744 H 0 0 0 0 0 0 0 0 0 0 0 0
  23722. -2.3238 0.4119 -0.2501 H 0 0 0 0 0 0 0 0 0 0 0 0
  23723. -1.6631 -1.6929 0.9217 H 0 0 0 0 0 0 0 0 0 0 0 0
  23724. 2.3464 -0.8546 0.4954 H 0 0 0 0 0 0 0 0 0 0 0 0
  23725. 1.8678 1.2883 -0.6957 H 0 0 0 0 0 0 0 0 0 0 0 0
  23726. 1 2 2 0
  23727. 2 3 1 0
  23728. 3 4 2 0
  23729. 4 5 1 0
  23730. 5 6 2 0
  23731. 6 1 1 0
  23732. 1 7 1 0
  23733. 2 8 1 0
  23734. 3 9 1 0
  23735. 5 10 1 0
  23736. 6 11 1 0
  23737. M END
  23738. $$$$
  23739. RDKit 3D
  23740. 11 11 0 0 0 0 0 0 0 0999 V2000
  23741. -0.2702 1.0108 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0
  23742. -1.2785 0.1657 -0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0
  23743. -0.9129 -1.0063 0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0
  23744. 0.3682 -1.3774 0.7549 N 0 0 0 0 0 0 0 0 0 0 0 0
  23745. 1.3253 -0.5368 0.3053 C 0 0 0 0 0 0 0 0 0 0 0 0
  23746. 1.0589 0.6560 -0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0
  23747. -0.5180 1.9381 -1.0622 H 0 0 0 0 0 0 0 0 0 0 0 0
  23748. -2.3238 0.4135 -0.2475 H 0 0 0 0 0 0 0 0 0 0 0 0
  23749. -1.6631 -1.6987 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0
  23750. 2.3464 -0.8577 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0
  23751. 1.8678 1.2927 -0.6876 H 0 0 0 0 0 0 0 0 0 0 0 0
  23752. 1 2 2 0
  23753. 2 3 1 0
  23754. 3 4 2 0
  23755. 4 5 1 0
  23756. 5 6 2 0
  23757. 6 1 1 0
  23758. 1 7 1 0
  23759. 2 8 1 0
  23760. 3 9 1 0
  23761. 5 10 1 0
  23762. 6 11 1 0
  23763. M END
  23764. $$$$
  23765. RDKit 3D
  23766. 11 11 0 0 0 0 0 0 0 0999 V2000
  23767. -0.2702 1.0142 -0.5476 C 0 0 0 0 0 0 0 0 0 0 0 0
  23768. -1.2785 0.1664 -0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0
  23769. -0.9129 -1.0096 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0
  23770. 0.3682 -1.3821 0.7462 N 0 0 0 0 0 0 0 0 0 0 0 0
  23771. 1.3253 -0.5387 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0
  23772. 1.0589 0.6582 -0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0
  23773. -0.5180 1.9447 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0
  23774. -2.3238 0.4150 -0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0
  23775. -1.6631 -1.7044 0.9003 H 0 0 0 0 0 0 0 0 0 0 0 0
  23776. 2.3464 -0.8607 0.4846 H 0 0 0 0 0 0 0 0 0 0 0 0
  23777. 1.8678 1.2970 -0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0
  23778. 1 2 2 0
  23779. 2 3 1 0
  23780. 3 4 2 0
  23781. 4 5 1 0
  23782. 5 6 2 0
  23783. 6 1 1 0
  23784. 1 7 1 0
  23785. 2 8 1 0
  23786. 3 9 1 0
  23787. 5 10 1 0
  23788. 6 11 1 0
  23789. M END
  23790. $$$$
  23791. RDKit 3D
  23792. 11 11 0 0 0 0 0 0 0 0999 V2000
  23793. -0.2702 1.0177 -0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0
  23794. -1.2785 0.1670 -0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0
  23795. -0.9129 -1.0130 0.5277 C 0 0 0 0 0 0 0 0 0 0 0 0
  23796. 0.3682 -1.3868 0.7376 N 0 0 0 0 0 0 0 0 0 0 0 0
  23797. 1.3253 -0.5406 0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0
  23798. 1.0589 0.6603 -0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0
  23799. -0.5180 1.9513 -1.0378 H 0 0 0 0 0 0 0 0 0 0 0 0
  23800. -2.3238 0.4166 -0.2423 H 0 0 0 0 0 0 0 0 0 0 0 0
  23801. -1.6631 -1.7100 0.8896 H 0 0 0 0 0 0 0 0 0 0 0 0
  23802. 2.3464 -0.8638 0.4792 H 0 0 0 0 0 0 0 0 0 0 0 0
  23803. 1.8678 1.3012 -0.6713 H 0 0 0 0 0 0 0 0 0 0 0 0
  23804. 1 2 2 0
  23805. 2 3 1 0
  23806. 3 4 2 0
  23807. 4 5 1 0
  23808. 5 6 2 0
  23809. 6 1 1 0
  23810. 1 7 1 0
  23811. 2 8 1 0
  23812. 3 9 1 0
  23813. 5 10 1 0
  23814. 6 11 1 0
  23815. M END
  23816. $$$$
  23817. RDKit 3D
  23818. 11 11 0 0 0 0 0 0 0 0999 V2000
  23819. -0.2702 1.0210 -0.5348 C 0 0 0 0 0 0 0 0 0 0 0 0
  23820. -1.2785 0.1676 -0.0993 C 0 0 0 0 0 0 0 0 0 0 0 0
  23821. -0.9129 -1.0163 0.5213 C 0 0 0 0 0 0 0 0 0 0 0 0
  23822. 0.3682 -1.3914 0.7288 N 0 0 0 0 0 0 0 0 0 0 0 0
  23823. 1.3253 -0.5424 0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0
  23824. 1.0589 0.6624 -0.3355 C 0 0 0 0 0 0 0 0 0 0 0 0
  23825. -0.5180 1.9578 -1.0255 H 0 0 0 0 0 0 0 0 0 0 0 0
  23826. -2.3238 0.4181 -0.2397 H 0 0 0 0 0 0 0 0 0 0 0 0
  23827. -1.6631 -1.7155 0.8788 H 0 0 0 0 0 0 0 0 0 0 0 0
  23828. 2.3464 -0.8667 0.4738 H 0 0 0 0 0 0 0 0 0 0 0 0
  23829. 1.8678 1.3054 -0.6631 H 0 0 0 0 0 0 0 0 0 0 0 0
  23830. 1 2 2 0
  23831. 2 3 1 0
  23832. 3 4 2 0
  23833. 4 5 1 0
  23834. 5 6 2 0
  23835. 6 1 1 0
  23836. 1 7 1 0
  23837. 2 8 1 0
  23838. 3 9 1 0
  23839. 5 10 1 0
  23840. 6 11 1 0
  23841. M END
  23842. $$$$
  23843. RDKit 3D
  23844. 11 11 0 0 0 0 0 0 0 0999 V2000
  23845. -0.2702 1.0244 -0.5284 C 0 0 0 0 0 0 0 0 0 0 0 0
  23846. -1.2785 0.1683 -0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0
  23847. -0.9129 -1.0195 0.5149 C 0 0 0 0 0 0 0 0 0 0 0 0
  23848. 0.3682 -1.3960 0.7201 N 0 0 0 0 0 0 0 0 0 0 0 0
  23849. 1.3253 -0.5443 0.2918 C 0 0 0 0 0 0 0 0 0 0 0 0
  23850. 1.0589 0.6645 -0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0
  23851. -0.5180 1.9642 -1.0132 H 0 0 0 0 0 0 0 0 0 0 0 0
  23852. -2.3238 0.4196 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0
  23853. -1.6631 -1.7210 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0
  23854. 2.3464 -0.8697 0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0
  23855. 1.8678 1.3095 -0.6549 H 0 0 0 0 0 0 0 0 0 0 0 0
  23856. 1 2 2 0
  23857. 2 3 1 0
  23858. 3 4 2 0
  23859. 4 5 1 0
  23860. 5 6 2 0
  23861. 6 1 1 0
  23862. 1 7 1 0
  23863. 2 8 1 0
  23864. 3 9 1 0
  23865. 5 10 1 0
  23866. 6 11 1 0
  23867. M END
  23868. $$$$
  23869. RDKit 3D
  23870. 11 11 0 0 0 0 0 0 0 0999 V2000
  23871. -0.2702 1.0277 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0
  23872. -1.2785 0.1689 -0.0972 C 0 0 0 0 0 0 0 0 0 0 0 0
  23873. -0.9129 -1.0227 0.5085 C 0 0 0 0 0 0 0 0 0 0 0 0
  23874. 0.3682 -1.4005 0.7113 N 0 0 0 0 0 0 0 0 0 0 0 0
  23875. 1.3253 -0.5461 0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0
  23876. 1.0589 0.6666 -0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0
  23877. -0.5180 1.9705 -1.0008 H 0 0 0 0 0 0 0 0 0 0 0 0
  23878. -2.3238 0.4211 -0.2344 H 0 0 0 0 0 0 0 0 0 0 0 0
  23879. -1.6631 -1.7264 0.8572 H 0 0 0 0 0 0 0 0 0 0 0 0
  23880. 2.3464 -0.8726 0.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
  23881. 1.8678 1.3136 -0.6467 H 0 0 0 0 0 0 0 0 0 0 0 0
  23882. 1 2 2 0
  23883. 2 3 1 0
  23884. 3 4 2 0
  23885. 4 5 1 0
  23886. 5 6 2 0
  23887. 6 1 1 0
  23888. 1 7 1 0
  23889. 2 8 1 0
  23890. 3 9 1 0
  23891. 5 10 1 0
  23892. 6 11 1 0
  23893. M END
  23894. $$$$
  23895. RDKit 3D
  23896. 11 11 0 0 0 0 0 0 0 0999 V2000
  23897. -0.2702 1.0309 -0.5155 C 0 0 0 0 0 0 0 0 0 0 0 0
  23898. -1.2785 0.1695 -0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0
  23899. -0.9129 -1.0259 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0
  23900. 0.3682 -1.4049 0.7025 N 0 0 0 0 0 0 0 0 0 0 0 0
  23901. 1.3253 -0.5479 0.2849 C 0 0 0 0 0 0 0 0 0 0 0 0
  23902. 1.0589 0.6687 -0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0
  23903. -0.5180 1.9768 -0.9884 H 0 0 0 0 0 0 0 0 0 0 0 0
  23904. -2.3238 0.4225 -0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
  23905. -1.6631 -1.7318 0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0
  23906. 2.3464 -0.8755 0.4574 H 0 0 0 0 0 0 0 0 0 0 0 0
  23907. 1.8678 1.3177 -0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0
  23908. 1 2 2 0
  23909. 2 3 1 0
  23910. 3 4 2 0
  23911. 4 5 1 0
  23912. 5 6 2 0
  23913. 6 1 1 0
  23914. 1 7 1 0
  23915. 2 8 1 0
  23916. 3 9 1 0
  23917. 5 10 1 0
  23918. 6 11 1 0
  23919. M END
  23920. $$$$
  23921. RDKit 3D
  23922. 11 11 0 0 0 0 0 0 0 0999 V2000
  23923. -0.2702 1.0342 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0
  23924. -1.2785 0.1701 -0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0
  23925. -0.9129 -1.0290 0.4956 C 0 0 0 0 0 0 0 0 0 0 0 0
  23926. 0.3682 -1.4093 0.6936 N 0 0 0 0 0 0 0 0 0 0 0 0
  23927. 1.3253 -0.5497 0.2815 C 0 0 0 0 0 0 0 0 0 0 0 0
  23928. 1.0589 0.6707 -0.3187 C 0 0 0 0 0 0 0 0 0 0 0 0
  23929. -0.5180 1.9829 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
  23930. -2.3238 0.4240 -0.2291 H 0 0 0 0 0 0 0 0 0 0 0 0
  23931. -1.6631 -1.7371 0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0
  23932. 2.3464 -0.8784 0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0
  23933. 1.8678 1.3217 -0.6301 H 0 0 0 0 0 0 0 0 0 0 0 0
  23934. 1 2 2 0
  23935. 2 3 1 0
  23936. 3 4 2 0
  23937. 4 5 1 0
  23938. 5 6 2 0
  23939. 6 1 1 0
  23940. 1 7 1 0
  23941. 2 8 1 0
  23942. 3 9 1 0
  23943. 5 10 1 0
  23944. 6 11 1 0
  23945. M END
  23946. $$$$
  23947. RDKit 3D
  23948. 11 11 0 0 0 0 0 0 0 0999 V2000
  23949. -0.2702 1.0373 -0.5025 C 0 0 0 0 0 0 0 0 0 0 0 0
  23950. -1.2785 0.1707 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
  23951. -0.9129 -1.0321 0.4891 C 0 0 0 0 0 0 0 0 0 0 0 0
  23952. 0.3682 -1.4136 0.6848 N 0 0 0 0 0 0 0 0 0 0 0 0
  23953. 1.3253 -0.5515 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0
  23954. 1.0589 0.6727 -0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0
  23955. -0.5180 1.9890 -0.9635 H 0 0 0 0 0 0 0 0 0 0 0 0
  23956. -2.3238 0.4254 -0.2264 H 0 0 0 0 0 0 0 0 0 0 0 0
  23957. -1.6631 -1.7423 0.8245 H 0 0 0 0 0 0 0 0 0 0 0 0
  23958. 2.3464 -0.8812 0.4463 H 0 0 0 0 0 0 0 0 0 0 0 0
  23959. 1.8678 1.3256 -0.6218 H 0 0 0 0 0 0 0 0 0 0 0 0
  23960. 1 2 2 0
  23961. 2 3 1 0
  23962. 3 4 2 0
  23963. 4 5 1 0
  23964. 5 6 2 0
  23965. 6 1 1 0
  23966. 1 7 1 0
  23967. 2 8 1 0
  23968. 3 9 1 0
  23969. 5 10 1 0
  23970. 6 11 1 0
  23971. M END
  23972. $$$$
  23973. RDKit 3D
  23974. 11 11 0 0 0 0 0 0 0 0999 V2000
  23975. -0.2702 1.0405 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0
  23976. -1.2785 0.1713 -0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0
  23977. -0.9129 -1.0352 0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0
  23978. 0.3682 -1.4179 0.6759 N 0 0 0 0 0 0 0 0 0 0 0 0
  23979. 1.3253 -0.5532 0.2745 C 0 0 0 0 0 0 0 0 0 0 0 0
  23980. 1.0589 0.6746 -0.3103 C 0 0 0 0 0 0 0 0 0 0 0 0
  23981. -0.5180 1.9950 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
  23982. -2.3238 0.4268 -0.2237 H 0 0 0 0 0 0 0 0 0 0 0 0
  23983. -1.6631 -1.7474 0.8135 H 0 0 0 0 0 0 0 0 0 0 0 0
  23984. 2.3464 -0.8840 0.4408 H 0 0 0 0 0 0 0 0 0 0 0 0
  23985. 1.8678 1.3295 -0.6134 H 0 0 0 0 0 0 0 0 0 0 0 0
  23986. 1 2 2 0
  23987. 2 3 1 0
  23988. 3 4 2 0
  23989. 4 5 1 0
  23990. 5 6 2 0
  23991. 6 1 1 0
  23992. 1 7 1 0
  23993. 2 8 1 0
  23994. 3 9 1 0
  23995. 5 10 1 0
  23996. 6 11 1 0
  23997. M END
  23998. $$$$
  23999. RDKit 3D
  24000. 11 11 0 0 0 0 0 0 0 0999 V2000
  24001. -0.2702 1.0436 -0.4894 C 0 0 0 0 0 0 0 0 0 0 0 0
  24002. -1.2785 0.1718 -0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0
  24003. -0.9129 -1.0382 0.4761 C 0 0 0 0 0 0 0 0 0 0 0 0
  24004. 0.3682 -1.4221 0.6669 N 0 0 0 0 0 0 0 0 0 0 0 0
  24005. 1.3253 -0.5549 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0
  24006. 1.0589 0.6766 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0
  24007. -0.5180 2.0010 -0.9384 H 0 0 0 0 0 0 0 0 0 0 0 0
  24008. -2.3238 0.4282 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  24009. -1.6631 -1.7525 0.8026 H 0 0 0 0 0 0 0 0 0 0 0 0
  24010. 2.3464 -0.8867 0.4352 H 0 0 0 0 0 0 0 0 0 0 0 0
  24011. 1.8678 1.3333 -0.6051 H 0 0 0 0 0 0 0 0 0 0 0 0
  24012. 1 2 2 0
  24013. 2 3 1 0
  24014. 3 4 2 0
  24015. 4 5 1 0
  24016. 5 6 2 0
  24017. 6 1 1 0
  24018. 1 7 1 0
  24019. 2 8 1 0
  24020. 3 9 1 0
  24021. 5 10 1 0
  24022. 6 11 1 0
  24023. M END
  24024. $$$$
  24025. RDKit 3D
  24026. 11 11 0 0 0 0 0 0 0 0999 V2000
  24027. -0.2702 1.0466 -0.4829 C 0 0 0 0 0 0 0 0 0 0 0 0
  24028. -1.2785 0.1724 -0.0908 C 0 0 0 0 0 0 0 0 0 0 0 0
  24029. -0.9129 -1.0412 0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0
  24030. 0.3682 -1.4263 0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0
  24031. 1.3253 -0.5566 0.2675 C 0 0 0 0 0 0 0 0 0 0 0 0
  24032. 1.0589 0.6785 -0.3018 C 0 0 0 0 0 0 0 0 0 0 0 0
  24033. -0.5180 2.0068 -0.9258 H 0 0 0 0 0 0 0 0 0 0 0 0
  24034. -2.3238 0.4296 -0.2184 H 0 0 0 0 0 0 0 0 0 0 0 0
  24035. -1.6631 -1.7575 0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0
  24036. 2.3464 -0.8895 0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0
  24037. 1.8678 1.3371 -0.5967 H 0 0 0 0 0 0 0 0 0 0 0 0
  24038. 1 2 2 0
  24039. 2 3 1 0
  24040. 3 4 2 0
  24041. 4 5 1 0
  24042. 5 6 2 0
  24043. 6 1 1 0
  24044. 1 7 1 0
  24045. 2 8 1 0
  24046. 3 9 1 0
  24047. 5 10 1 0
  24048. 6 11 1 0
  24049. M END
  24050. $$$$
  24051. RDKit 3D
  24052. 11 11 0 0 0 0 0 0 0 0999 V2000
  24053. -0.2702 1.0496 -0.4763 C 0 0 0 0 0 0 0 0 0 0 0 0
  24054. -1.2785 0.1730 -0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0
  24055. -0.9129 -1.0441 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0
  24056. 0.3682 -1.4304 0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0
  24057. 1.3253 -0.5583 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
  24058. 1.0589 0.6803 -0.2975 C 0 0 0 0 0 0 0 0 0 0 0 0
  24059. -0.5180 2.0126 -0.9132 H 0 0 0 0 0 0 0 0 0 0 0 0
  24060. -2.3238 0.4310 -0.2156 H 0 0 0 0 0 0 0 0 0 0 0 0
  24061. -1.6631 -1.7625 0.7805 H 0 0 0 0 0 0 0 0 0 0 0 0
  24062. 2.3464 -0.8921 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  24063. 1.8678 1.3408 -0.5883 H 0 0 0 0 0 0 0 0 0 0 0 0
  24064. 1 2 2 0
  24065. 2 3 1 0
  24066. 3 4 2 0
  24067. 4 5 1 0
  24068. 5 6 2 0
  24069. 6 1 1 0
  24070. 1 7 1 0
  24071. 2 8 1 0
  24072. 3 9 1 0
  24073. 5 10 1 0
  24074. 6 11 1 0
  24075. M END
  24076. $$$$
  24077. RDKit 3D
  24078. 11 11 0 0 0 0 0 0 0 0999 V2000
  24079. -0.2702 1.0526 -0.4697 C 0 0 0 0 0 0 0 0 0 0 0 0
  24080. -1.2785 0.1735 -0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0
  24081. -0.9129 -1.0470 0.4564 C 0 0 0 0 0 0 0 0 0 0 0 0
  24082. 0.3682 -1.4344 0.6400 N 0 0 0 0 0 0 0 0 0 0 0 0
  24083. 1.3253 -0.5599 0.2605 C 0 0 0 0 0 0 0 0 0 0 0 0
  24084. 1.0589 0.6822 -0.2932 C 0 0 0 0 0 0 0 0 0 0 0 0
  24085. -0.5180 2.0183 -0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0
  24086. -2.3238 0.4323 -0.2129 H 0 0 0 0 0 0 0 0 0 0 0 0
  24087. -1.6631 -1.7673 0.7694 H 0 0 0 0 0 0 0 0 0 0 0 0
  24088. 2.3464 -0.8948 0.4184 H 0 0 0 0 0 0 0 0 0 0 0 0
  24089. 1.8678 1.3445 -0.5798 H 0 0 0 0 0 0 0 0 0 0 0 0
  24090. 1 2 2 0
  24091. 2 3 1 0
  24092. 3 4 2 0
  24093. 4 5 1 0
  24094. 5 6 2 0
  24095. 6 1 1 0
  24096. 1 7 1 0
  24097. 2 8 1 0
  24098. 3 9 1 0
  24099. 5 10 1 0
  24100. 6 11 1 0
  24101. M END
  24102. $$$$
  24103. RDKit 3D
  24104. 11 11 0 0 0 0 0 0 0 0999 V2000
  24105. -0.2702 1.0555 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0
  24106. -1.2785 0.1741 -0.0875 C 0 0 0 0 0 0 0 0 0 0 0 0
  24107. -0.9129 -1.0498 0.4499 C 0 0 0 0 0 0 0 0 0 0 0 0
  24108. 0.3682 -1.4384 0.6310 N 0 0 0 0 0 0 0 0 0 0 0 0
  24109. 1.3253 -0.5615 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  24110. 1.0589 0.6840 -0.2889 C 0 0 0 0 0 0 0 0 0 0 0 0
  24111. -0.5180 2.0239 -0.8878 H 0 0 0 0 0 0 0 0 0 0 0 0
  24112. -2.3238 0.4336 -0.2102 H 0 0 0 0 0 0 0 0 0 0 0 0
  24113. -1.6631 -1.7721 0.7583 H 0 0 0 0 0 0 0 0 0 0 0 0
  24114. 2.3464 -0.8974 0.4128 H 0 0 0 0 0 0 0 0 0 0 0 0
  24115. 1.8678 1.3481 -0.5714 H 0 0 0 0 0 0 0 0 0 0 0 0
  24116. 1 2 2 0
  24117. 2 3 1 0
  24118. 3 4 2 0
  24119. 4 5 1 0
  24120. 5 6 2 0
  24121. 6 1 1 0
  24122. 1 7 1 0
  24123. 2 8 1 0
  24124. 3 9 1 0
  24125. 5 10 1 0
  24126. 6 11 1 0
  24127. M END
  24128. $$$$
  24129. RDKit 3D
  24130. 11 11 0 0 0 0 0 0 0 0999 V2000
  24131. -0.2702 1.0584 -0.4564 C 0 0 0 0 0 0 0 0 0 0 0 0
  24132. -1.2785 0.1746 -0.0864 C 0 0 0 0 0 0 0 0 0 0 0 0
  24133. -0.9129 -1.0526 0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0
  24134. 0.3682 -1.4423 0.6219 N 0 0 0 0 0 0 0 0 0 0 0 0
  24135. 1.3253 -0.5631 0.2535 C 0 0 0 0 0 0 0 0 0 0 0 0
  24136. 1.0589 0.6858 -0.2846 C 0 0 0 0 0 0 0 0 0 0 0 0
  24137. -0.5180 2.0295 -0.8751 H 0 0 0 0 0 0 0 0 0 0 0 0
  24138. -2.3238 0.4349 -0.2075 H 0 0 0 0 0 0 0 0 0 0 0 0
  24139. -1.6631 -1.7769 0.7471 H 0 0 0 0 0 0 0 0 0 0 0 0
  24140. 2.3464 -0.9000 0.4071 H 0 0 0 0 0 0 0 0 0 0 0 0
  24141. 1.8678 1.3516 -0.5629 H 0 0 0 0 0 0 0 0 0 0 0 0
  24142. 1 2 2 0
  24143. 2 3 1 0
  24144. 3 4 2 0
  24145. 4 5 1 0
  24146. 5 6 2 0
  24147. 6 1 1 0
  24148. 1 7 1 0
  24149. 2 8 1 0
  24150. 3 9 1 0
  24151. 5 10 1 0
  24152. 6 11 1 0
  24153. M END
  24154. $$$$
  24155. RDKit 3D
  24156. 11 11 0 0 0 0 0 0 0 0999 V2000
  24157. -0.2702 1.0613 -0.4497 C 0 0 0 0 0 0 0 0 0 0 0 0
  24158. -1.2785 0.1752 -0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0
  24159. -0.9129 -1.0554 0.4366 C 0 0 0 0 0 0 0 0 0 0 0 0
  24160. 0.3682 -1.4462 0.6129 N 0 0 0 0 0 0 0 0 0 0 0 0
  24161. 1.3253 -0.5647 0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0
  24162. 1.0589 0.6876 -0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0
  24163. -0.5180 2.0349 -0.8623 H 0 0 0 0 0 0 0 0 0 0 0 0
  24164. -2.3238 0.4362 -0.2048 H 0 0 0 0 0 0 0 0 0 0 0 0
  24165. -1.6631 -1.7815 0.7359 H 0 0 0 0 0 0 0 0 0 0 0 0
  24166. 2.3464 -0.9025 0.4015 H 0 0 0 0 0 0 0 0 0 0 0 0
  24167. 1.8678 1.3552 -0.5544 H 0 0 0 0 0 0 0 0 0 0 0 0
  24168. 1 2 2 0
  24169. 2 3 1 0
  24170. 3 4 2 0
  24171. 4 5 1 0
  24172. 5 6 2 0
  24173. 6 1 1 0
  24174. 1 7 1 0
  24175. 2 8 1 0
  24176. 3 9 1 0
  24177. 5 10 1 0
  24178. 6 11 1 0
  24179. M END
  24180. $$$$
  24181. RDKit 3D
  24182. 11 11 0 0 0 0 0 0 0 0999 V2000
  24183. -0.2702 1.0641 -0.4431 C 0 0 0 0 0 0 0 0 0 0 0 0
  24184. -1.2785 0.1757 -0.0842 C 0 0 0 0 0 0 0 0 0 0 0 0
  24185. -0.9129 -1.0581 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0
  24186. 0.3682 -1.4501 0.6038 N 0 0 0 0 0 0 0 0 0 0 0 0
  24187. 1.3253 -0.5663 0.2464 C 0 0 0 0 0 0 0 0 0 0 0 0
  24188. 1.0589 0.6894 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0
  24189. -0.5180 2.0403 -0.8495 H 0 0 0 0 0 0 0 0 0 0 0 0
  24190. -2.3238 0.4375 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0
  24191. -1.6631 -1.7861 0.7247 H 0 0 0 0 0 0 0 0 0 0 0 0
  24192. 2.3464 -0.9050 0.3958 H 0 0 0 0 0 0 0 0 0 0 0 0
  24193. 1.8678 1.3586 -0.5459 H 0 0 0 0 0 0 0 0 0 0 0 0
  24194. 1 2 2 0
  24195. 2 3 1 0
  24196. 3 4 2 0
  24197. 4 5 1 0
  24198. 5 6 2 0
  24199. 6 1 1 0
  24200. 1 7 1 0
  24201. 2 8 1 0
  24202. 3 9 1 0
  24203. 5 10 1 0
  24204. 6 11 1 0
  24205. M END
  24206. $$$$
  24207. RDKit 3D
  24208. 11 11 0 0 0 0 0 0 0 0999 V2000
  24209. -0.2702 1.0668 -0.4364 C 0 0 0 0 0 0 0 0 0 0 0 0
  24210. -1.2785 0.1762 -0.0831 C 0 0 0 0 0 0 0 0 0 0 0 0
  24211. -0.9129 -1.0608 0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0
  24212. 0.3682 -1.4538 0.5946 N 0 0 0 0 0 0 0 0 0 0 0 0
  24213. 1.3253 -0.5678 0.2428 C 0 0 0 0 0 0 0 0 0 0 0 0
  24214. 1.0589 0.6911 -0.2716 C 0 0 0 0 0 0 0 0 0 0 0 0
  24215. -0.5180 2.0456 -0.8367 H 0 0 0 0 0 0 0 0 0 0 0 0
  24216. -2.3238 0.4388 -0.1993 H 0 0 0 0 0 0 0 0 0 0 0 0
  24217. -1.6631 -1.7906 0.7135 H 0 0 0 0 0 0 0 0 0 0 0 0
  24218. 2.3464 -0.9075 0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0
  24219. 1.8678 1.3620 -0.5373 H 0 0 0 0 0 0 0 0 0 0 0 0
  24220. 1 2 2 0
  24221. 2 3 1 0
  24222. 3 4 2 0
  24223. 4 5 1 0
  24224. 5 6 2 0
  24225. 6 1 1 0
  24226. 1 7 1 0
  24227. 2 8 1 0
  24228. 3 9 1 0
  24229. 5 10 1 0
  24230. 6 11 1 0
  24231. M END
  24232. $$$$
  24233. RDKit 3D
  24234. 11 11 0 0 0 0 0 0 0 0999 V2000
  24235. -0.2702 1.0696 -0.4297 C 0 0 0 0 0 0 0 0 0 0 0 0
  24236. -1.2785 0.1768 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  24237. -0.9129 -1.0634 0.4167 C 0 0 0 0 0 0 0 0 0 0 0 0
  24238. 0.3682 -1.4575 0.5855 N 0 0 0 0 0 0 0 0 0 0 0 0
  24239. 1.3253 -0.5693 0.2392 C 0 0 0 0 0 0 0 0 0 0 0 0
  24240. 1.0589 0.6928 -0.2673 C 0 0 0 0 0 0 0 0 0 0 0 0
  24241. -0.5180 2.0508 -0.8238 H 0 0 0 0 0 0 0 0 0 0 0 0
  24242. -2.3238 0.4400 -0.1965 H 0 0 0 0 0 0 0 0 0 0 0 0
  24243. -1.6631 -1.7951 0.7022 H 0 0 0 0 0 0 0 0 0 0 0 0
  24244. 2.3464 -0.9099 0.3844 H 0 0 0 0 0 0 0 0 0 0 0 0
  24245. 1.8678 1.3654 -0.5287 H 0 0 0 0 0 0 0 0 0 0 0 0
  24246. 1 2 2 0
  24247. 2 3 1 0
  24248. 3 4 2 0
  24249. 4 5 1 0
  24250. 5 6 2 0
  24251. 6 1 1 0
  24252. 1 7 1 0
  24253. 2 8 1 0
  24254. 3 9 1 0
  24255. 5 10 1 0
  24256. 6 11 1 0
  24257. M END
  24258. $$$$
  24259. RDKit 3D
  24260. 11 11 0 0 0 0 0 0 0 0999 V2000
  24261. -0.2702 1.0722 -0.4229 C 0 0 0 0 0 0 0 0 0 0 0 0
  24262. -1.2785 0.1773 -0.0809 C 0 0 0 0 0 0 0 0 0 0 0 0
  24263. -0.9129 -1.0660 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0
  24264. 0.3682 -1.4612 0.5763 N 0 0 0 0 0 0 0 0 0 0 0 0
  24265. 1.3253 -0.5708 0.2357 C 0 0 0 0 0 0 0 0 0 0 0 0
  24266. 1.0589 0.6944 -0.2629 C 0 0 0 0 0 0 0 0 0 0 0 0
  24267. -0.5180 2.0560 -0.8109 H 0 0 0 0 0 0 0 0 0 0 0 0
  24268. -2.3238 0.4412 -0.1937 H 0 0 0 0 0 0 0 0 0 0 0 0
  24269. -1.6631 -1.7995 0.6909 H 0 0 0 0 0 0 0 0 0 0 0 0
  24270. 2.3464 -0.9123 0.3787 H 0 0 0 0 0 0 0 0 0 0 0 0
  24271. 1.8678 1.3687 -0.5202 H 0 0 0 0 0 0 0 0 0 0 0 0
  24272. 1 2 2 0
  24273. 2 3 1 0
  24274. 3 4 2 0
  24275. 4 5 1 0
  24276. 5 6 2 0
  24277. 6 1 1 0
  24278. 1 7 1 0
  24279. 2 8 1 0
  24280. 3 9 1 0
  24281. 5 10 1 0
  24282. 6 11 1 0
  24283. M END
  24284. $$$$
  24285. RDKit 3D
  24286. 11 11 0 0 0 0 0 0 0 0999 V2000
  24287. -0.2702 1.0749 -0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0
  24288. -1.2785 0.1778 -0.0798 C 0 0 0 0 0 0 0 0 0 0 0 0
  24289. -0.9129 -1.0686 0.4033 C 0 0 0 0 0 0 0 0 0 0 0 0
  24290. 0.3682 -1.4648 0.5671 N 0 0 0 0 0 0 0 0 0 0 0 0
  24291. 1.3253 -0.5723 0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
  24292. 1.0589 0.6961 -0.2586 C 0 0 0 0 0 0 0 0 0 0 0 0
  24293. -0.5180 2.0610 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0
  24294. -2.3238 0.4425 -0.1909 H 0 0 0 0 0 0 0 0 0 0 0 0
  24295. -1.6631 -1.8038 0.6796 H 0 0 0 0 0 0 0 0 0 0 0 0
  24296. 2.3464 -0.9147 0.3729 H 0 0 0 0 0 0 0 0 0 0 0 0
  24297. 1.8678 1.3719 -0.5115 H 0 0 0 0 0 0 0 0 0 0 0 0
  24298. 1 2 2 0
  24299. 2 3 1 0
  24300. 3 4 2 0
  24301. 4 5 1 0
  24302. 5 6 2 0
  24303. 6 1 1 0
  24304. 1 7 1 0
  24305. 2 8 1 0
  24306. 3 9 1 0
  24307. 5 10 1 0
  24308. 6 11 1 0
  24309. M END
  24310. $$$$
  24311. RDKit 3D
  24312. 11 11 0 0 0 0 0 0 0 0999 V2000
  24313. -0.2702 1.0775 -0.4094 C 0 0 0 0 0 0 0 0 0 0 0 0
  24314. -1.2785 0.1783 -0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0
  24315. -0.9129 -1.0711 0.3965 C 0 0 0 0 0 0 0 0 0 0 0 0
  24316. 0.3682 -1.4683 0.5579 N 0 0 0 0 0 0 0 0 0 0 0 0
  24317. 1.3253 -0.5737 0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0
  24318. 1.0589 0.6977 -0.2542 C 0 0 0 0 0 0 0 0 0 0 0 0
  24319. -0.5180 2.0660 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0
  24320. -2.3238 0.4436 -0.1882 H 0 0 0 0 0 0 0 0 0 0 0 0
  24321. -1.6631 -1.8080 0.6683 H 0 0 0 0 0 0 0 0 0 0 0 0
  24322. 2.3464 -0.9170 0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0
  24323. 1.8678 1.3751 -0.5029 H 0 0 0 0 0 0 0 0 0 0 0 0
  24324. 1 2 2 0
  24325. 2 3 1 0
  24326. 3 4 2 0
  24327. 4 5 1 0
  24328. 5 6 2 0
  24329. 6 1 1 0
  24330. 1 7 1 0
  24331. 2 8 1 0
  24332. 3 9 1 0
  24333. 5 10 1 0
  24334. 6 11 1 0
  24335. M END
  24336. $$$$
  24337. RDKit 3D
  24338. 11 11 0 0 0 0 0 0 0 0999 V2000
  24339. -0.2702 1.0800 -0.4026 C 0 0 0 0 0 0 0 0 0 0 0 0
  24340. -1.2785 0.1788 -0.0775 C 0 0 0 0 0 0 0 0 0 0 0 0
  24341. -0.9129 -1.0736 0.3898 C 0 0 0 0 0 0 0 0 0 0 0 0
  24342. 0.3682 -1.4718 0.5487 N 0 0 0 0 0 0 0 0 0 0 0 0
  24343. 1.3253 -0.5752 0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0
  24344. 1.0589 0.6993 -0.2498 C 0 0 0 0 0 0 0 0 0 0 0 0
  24345. -0.5180 2.0709 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0
  24346. -2.3238 0.4448 -0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0
  24347. -1.6631 -1.8122 0.6569 H 0 0 0 0 0 0 0 0 0 0 0 0
  24348. 2.3464 -0.9193 0.3614 H 0 0 0 0 0 0 0 0 0 0 0 0
  24349. 1.8678 1.3782 -0.4943 H 0 0 0 0 0 0 0 0 0 0 0 0
  24350. 1 2 2 0
  24351. 2 3 1 0
  24352. 3 4 2 0
  24353. 4 5 1 0
  24354. 5 6 2 0
  24355. 6 1 1 0
  24356. 1 7 1 0
  24357. 2 8 1 0
  24358. 3 9 1 0
  24359. 5 10 1 0
  24360. 6 11 1 0
  24361. M END
  24362. $$$$
  24363. RDKit 3D
  24364. 11 11 0 0 0 0 0 0 0 0999 V2000
  24365. -0.2702 1.0825 -0.3958 C 0 0 0 0 0 0 0 0 0 0 0 0
  24366. -1.2785 0.1792 -0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0
  24367. -0.9129 -1.0760 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0
  24368. 0.3682 -1.4752 0.5394 N 0 0 0 0 0 0 0 0 0 0 0 0
  24369. 1.3253 -0.5766 0.2212 C 0 0 0 0 0 0 0 0 0 0 0 0
  24370. 1.0589 0.7008 -0.2454 C 0 0 0 0 0 0 0 0 0 0 0 0
  24371. -0.5180 2.0757 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0
  24372. -2.3238 0.4460 -0.1826 H 0 0 0 0 0 0 0 0 0 0 0 0
  24373. -1.6631 -1.8162 0.6455 H 0 0 0 0 0 0 0 0 0 0 0 0
  24374. 2.3464 -0.9215 0.3556 H 0 0 0 0 0 0 0 0 0 0 0 0
  24375. 1.8678 1.3813 -0.4856 H 0 0 0 0 0 0 0 0 0 0 0 0
  24376. 1 2 2 0
  24377. 2 3 1 0
  24378. 3 4 2 0
  24379. 4 5 1 0
  24380. 5 6 2 0
  24381. 6 1 1 0
  24382. 1 7 1 0
  24383. 2 8 1 0
  24384. 3 9 1 0
  24385. 5 10 1 0
  24386. 6 11 1 0
  24387. M END
  24388. $$$$
  24389. RDKit 3D
  24390. 11 11 0 0 0 0 0 0 0 0999 V2000
  24391. -0.2702 1.0850 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0
  24392. -1.2785 0.1797 -0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0
  24393. -0.9129 -1.0784 0.3763 C 0 0 0 0 0 0 0 0 0 0 0 0
  24394. 0.3682 -1.4786 0.5301 N 0 0 0 0 0 0 0 0 0 0 0 0
  24395. 1.3253 -0.5779 0.2176 C 0 0 0 0 0 0 0 0 0 0 0 0
  24396. 1.0589 0.7023 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0
  24397. -0.5180 2.0804 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0
  24398. -2.3238 0.4471 -0.1798 H 0 0 0 0 0 0 0 0 0 0 0 0
  24399. -1.6631 -1.8203 0.6341 H 0 0 0 0 0 0 0 0 0 0 0 0
  24400. 2.3464 -0.9238 0.3498 H 0 0 0 0 0 0 0 0 0 0 0 0
  24401. 1.8678 1.3843 -0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
  24402. 1 2 2 0
  24403. 2 3 1 0
  24404. 3 4 2 0
  24405. 4 5 1 0
  24406. 5 6 2 0
  24407. 6 1 1 0
  24408. 1 7 1 0
  24409. 2 8 1 0
  24410. 3 9 1 0
  24411. 5 10 1 0
  24412. 6 11 1 0
  24413. M END
  24414. $$$$
  24415. RDKit 3D
  24416. 11 11 0 0 0 0 0 0 0 0999 V2000
  24417. -0.2702 1.0874 -0.3822 C 0 0 0 0 0 0 0 0 0 0 0 0
  24418. -1.2785 0.1802 -0.0742 C 0 0 0 0 0 0 0 0 0 0 0 0
  24419. -0.9129 -1.0807 0.3695 C 0 0 0 0 0 0 0 0 0 0 0 0
  24420. 0.3682 -1.4819 0.5208 N 0 0 0 0 0 0 0 0 0 0 0 0
  24421. 1.3253 -0.5793 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0
  24422. 1.0589 0.7039 -0.2366 C 0 0 0 0 0 0 0 0 0 0 0 0
  24423. -0.5180 2.0851 -0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0
  24424. -2.3238 0.4482 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0
  24425. -1.6631 -1.8242 0.6226 H 0 0 0 0 0 0 0 0 0 0 0 0
  24426. 2.3464 -0.9259 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0
  24427. 1.8678 1.3873 -0.4682 H 0 0 0 0 0 0 0 0 0 0 0 0
  24428. 1 2 2 0
  24429. 2 3 1 0
  24430. 3 4 2 0
  24431. 4 5 1 0
  24432. 5 6 2 0
  24433. 6 1 1 0
  24434. 1 7 1 0
  24435. 2 8 1 0
  24436. 3 9 1 0
  24437. 5 10 1 0
  24438. 6 11 1 0
  24439. M END
  24440. $$$$
  24441. RDKit 3D
  24442. 11 11 0 0 0 0 0 0 0 0999 V2000
  24443. -0.2702 1.0898 -0.3754 C 0 0 0 0 0 0 0 0 0 0 0 0
  24444. -1.2785 0.1807 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
  24445. -0.9129 -1.0830 0.3627 C 0 0 0 0 0 0 0 0 0 0 0 0
  24446. 0.3682 -1.4851 0.5115 N 0 0 0 0 0 0 0 0 0 0 0 0
  24447. 1.3253 -0.5806 0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0
  24448. 1.0589 0.7053 -0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
  24449. -0.5180 2.0896 -0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0
  24450. -2.3238 0.4493 -0.1741 H 0 0 0 0 0 0 0 0 0 0 0 0
  24451. -1.6631 -1.8281 0.6111 H 0 0 0 0 0 0 0 0 0 0 0 0
  24452. 2.3464 -0.9281 0.3382 H 0 0 0 0 0 0 0 0 0 0 0 0
  24453. 1.8678 1.3902 -0.4595 H 0 0 0 0 0 0 0 0 0 0 0 0
  24454. 1 2 2 0
  24455. 2 3 1 0
  24456. 3 4 2 0
  24457. 4 5 1 0
  24458. 5 6 2 0
  24459. 6 1 1 0
  24460. 1 7 1 0
  24461. 2 8 1 0
  24462. 3 9 1 0
  24463. 5 10 1 0
  24464. 6 11 1 0
  24465. M END
  24466. $$$$
  24467. RDKit 3D
  24468. 11 11 0 0 0 0 0 0 0 0999 V2000
  24469. -0.2702 1.0921 -0.3685 C 0 0 0 0 0 0 0 0 0 0 0 0
  24470. -1.2785 0.1811 -0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0
  24471. -0.9129 -1.0853 0.3559 C 0 0 0 0 0 0 0 0 0 0 0 0
  24472. 0.3682 -1.4883 0.5022 N 0 0 0 0 0 0 0 0 0 0 0 0
  24473. 1.3253 -0.5819 0.2067 C 0 0 0 0 0 0 0 0 0 0 0 0
  24474. 1.0589 0.7068 -0.2277 C 0 0 0 0 0 0 0 0 0 0 0 0
  24475. -0.5180 2.0941 -0.7066 H 0 0 0 0 0 0 0 0 0 0 0 0
  24476. -2.3238 0.4504 -0.1713 H 0 0 0 0 0 0 0 0 0 0 0 0
  24477. -1.6631 -1.8319 0.5996 H 0 0 0 0 0 0 0 0 0 0 0 0
  24478. 2.3464 -0.9302 0.3324 H 0 0 0 0 0 0 0 0 0 0 0 0
  24479. 1.8678 1.3931 -0.4507 H 0 0 0 0 0 0 0 0 0 0 0 0
  24480. 1 2 2 0
  24481. 2 3 1 0
  24482. 3 4 2 0
  24483. 4 5 1 0
  24484. 5 6 2 0
  24485. 6 1 1 0
  24486. 1 7 1 0
  24487. 2 8 1 0
  24488. 3 9 1 0
  24489. 5 10 1 0
  24490. 6 11 1 0
  24491. M END
  24492. $$$$
  24493. RDKit 3D
  24494. 11 11 0 0 0 0 0 0 0 0999 V2000
  24495. -0.2702 1.0944 -0.3616 C 0 0 0 0 0 0 0 0 0 0 0 0
  24496. -1.2785 0.1816 -0.0707 C 0 0 0 0 0 0 0 0 0 0 0 0
  24497. -0.9129 -1.0875 0.3491 C 0 0 0 0 0 0 0 0 0 0 0 0
  24498. 0.3682 -1.4914 0.4928 N 0 0 0 0 0 0 0 0 0 0 0 0
  24499. 1.3253 -0.5832 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0
  24500. 1.0589 0.7082 -0.2233 C 0 0 0 0 0 0 0 0 0 0 0 0
  24501. -0.5180 2.0985 -0.6934 H 0 0 0 0 0 0 0 0 0 0 0 0
  24502. -2.3238 0.4515 -0.1685 H 0 0 0 0 0 0 0 0 0 0 0 0
  24503. -1.6631 -1.8356 0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0
  24504. 2.3464 -0.9323 0.3265 H 0 0 0 0 0 0 0 0 0 0 0 0
  24505. 1.8678 1.3959 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
  24506. 1 2 2 0
  24507. 2 3 1 0
  24508. 3 4 2 0
  24509. 4 5 1 0
  24510. 5 6 2 0
  24511. 6 1 1 0
  24512. 1 7 1 0
  24513. 2 8 1 0
  24514. 3 9 1 0
  24515. 5 10 1 0
  24516. 6 11 1 0
  24517. M END
  24518. $$$$
  24519. RDKit 3D
  24520. 11 11 0 0 0 0 0 0 0 0999 V2000
  24521. -0.2702 1.0967 -0.3548 C 0 0 0 0 0 0 0 0 0 0 0 0
  24522. -1.2785 0.1820 -0.0696 C 0 0 0 0 0 0 0 0 0 0 0 0
  24523. -0.9129 -1.0897 0.3422 C 0 0 0 0 0 0 0 0 0 0 0 0
  24524. 0.3682 -1.4945 0.4834 N 0 0 0 0 0 0 0 0 0 0 0 0
  24525. 1.3253 -0.5845 0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0
  24526. 1.0589 0.7096 -0.2188 C 0 0 0 0 0 0 0 0 0 0 0 0
  24527. -0.5180 2.1028 -0.6802 H 0 0 0 0 0 0 0 0 0 0 0 0
  24528. -2.3238 0.4525 -0.1656 H 0 0 0 0 0 0 0 0 0 0 0 0
  24529. -1.6631 -1.8393 0.5766 H 0 0 0 0 0 0 0 0 0 0 0 0
  24530. 2.3464 -0.9343 0.3206 H 0 0 0 0 0 0 0 0 0 0 0 0
  24531. 1.8678 1.3986 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
  24532. 1 2 2 0
  24533. 2 3 1 0
  24534. 3 4 2 0
  24535. 4 5 1 0
  24536. 5 6 2 0
  24537. 6 1 1 0
  24538. 1 7 1 0
  24539. 2 8 1 0
  24540. 3 9 1 0
  24541. 5 10 1 0
  24542. 6 11 1 0
  24543. M END
  24544. $$$$
  24545. RDKit 3D
  24546. 11 11 0 0 0 0 0 0 0 0999 V2000
  24547. -0.2702 1.0989 -0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0
  24548. -1.2785 0.1824 -0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0
  24549. -0.9129 -1.0918 0.3354 C 0 0 0 0 0 0 0 0 0 0 0 0
  24550. 0.3682 -1.4975 0.4740 N 0 0 0 0 0 0 0 0 0 0 0 0
  24551. 1.3253 -0.5857 0.1957 C 0 0 0 0 0 0 0 0 0 0 0 0
  24552. 1.0589 0.7109 -0.2143 C 0 0 0 0 0 0 0 0 0 0 0 0
  24553. -0.5180 2.1071 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0
  24554. -2.3238 0.4536 -0.1628 H 0 0 0 0 0 0 0 0 0 0 0 0
  24555. -1.6631 -1.8429 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0
  24556. 2.3464 -0.9363 0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0
  24557. 1.8678 1.4013 -0.4244 H 0 0 0 0 0 0 0 0 0 0 0 0
  24558. 1 2 2 0
  24559. 2 3 1 0
  24560. 3 4 2 0
  24561. 4 5 1 0
  24562. 5 6 2 0
  24563. 6 1 1 0
  24564. 1 7 1 0
  24565. 2 8 1 0
  24566. 3 9 1 0
  24567. 5 10 1 0
  24568. 6 11 1 0
  24569. M END
  24570. $$$$
  24571. RDKit 3D
  24572. 11 11 0 0 0 0 0 0 0 0999 V2000
  24573. -0.2702 1.1011 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0
  24574. -1.2785 0.1829 -0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0
  24575. -0.9129 -1.0939 0.3285 C 0 0 0 0 0 0 0 0 0 0 0 0
  24576. 0.3682 -1.5004 0.4646 N 0 0 0 0 0 0 0 0 0 0 0 0
  24577. 1.3253 -0.5870 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0
  24578. 1.0589 0.7123 -0.2099 C 0 0 0 0 0 0 0 0 0 0 0 0
  24579. -0.5180 2.1112 -0.6538 H 0 0 0 0 0 0 0 0 0 0 0 0
  24580. -2.3238 0.4546 -0.1599 H 0 0 0 0 0 0 0 0 0 0 0 0
  24581. -1.6631 -1.8464 0.5534 H 0 0 0 0 0 0 0 0 0 0 0 0
  24582. 2.3464 -0.9383 0.3089 H 0 0 0 0 0 0 0 0 0 0 0 0
  24583. 1.8678 1.4039 -0.4156 H 0 0 0 0 0 0 0 0 0 0 0 0
  24584. 1 2 2 0
  24585. 2 3 1 0
  24586. 3 4 2 0
  24587. 4 5 1 0
  24588. 5 6 2 0
  24589. 6 1 1 0
  24590. 1 7 1 0
  24591. 2 8 1 0
  24592. 3 9 1 0
  24593. 5 10 1 0
  24594. 6 11 1 0
  24595. M END
  24596. $$$$
  24597. RDKit 3D
  24598. 11 11 0 0 0 0 0 0 0 0999 V2000
  24599. -0.2702 1.1032 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0
  24600. -1.2785 0.1833 -0.0662 C 0 0 0 0 0 0 0 0 0 0 0 0
  24601. -0.9129 -1.0959 0.3216 C 0 0 0 0 0 0 0 0 0 0 0 0
  24602. 0.3682 -1.5033 0.4552 N 0 0 0 0 0 0 0 0 0 0 0 0
  24603. 1.3253 -0.5882 0.1883 C 0 0 0 0 0 0 0 0 0 0 0 0
  24604. 1.0589 0.7136 -0.2054 C 0 0 0 0 0 0 0 0 0 0 0 0
  24605. -0.5180 2.1153 -0.6405 H 0 0 0 0 0 0 0 0 0 0 0 0
  24606. -2.3238 0.4556 -0.1571 H 0 0 0 0 0 0 0 0 0 0 0 0
  24607. -1.6631 -1.8498 0.5418 H 0 0 0 0 0 0 0 0 0 0 0 0
  24608. 2.3464 -0.9402 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  24609. 1.8678 1.4065 -0.4068 H 0 0 0 0 0 0 0 0 0 0 0 0
  24610. 1 2 2 0
  24611. 2 3 1 0
  24612. 3 4 2 0
  24613. 4 5 1 0
  24614. 5 6 2 0
  24615. 6 1 1 0
  24616. 1 7 1 0
  24617. 2 8 1 0
  24618. 3 9 1 0
  24619. 5 10 1 0
  24620. 6 11 1 0
  24621. M END
  24622. $$$$
  24623. RDKit 3D
  24624. 11 11 0 0 0 0 0 0 0 0999 V2000
  24625. -0.2702 1.1053 -0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0
  24626. -1.2785 0.1837 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0
  24627. -0.9129 -1.0979 0.3147 C 0 0 0 0 0 0 0 0 0 0 0 0
  24628. 0.3682 -1.5062 0.4457 N 0 0 0 0 0 0 0 0 0 0 0 0
  24629. 1.3253 -0.5893 0.1846 C 0 0 0 0 0 0 0 0 0 0 0 0
  24630. 1.0589 0.7148 -0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0
  24631. -0.5180 2.1192 -0.6272 H 0 0 0 0 0 0 0 0 0 0 0 0
  24632. -2.3238 0.4566 -0.1542 H 0 0 0 0 0 0 0 0 0 0 0 0
  24633. -1.6631 -1.8532 0.5302 H 0 0 0 0 0 0 0 0 0 0 0 0
  24634. 2.3464 -0.9421 0.2971 H 0 0 0 0 0 0 0 0 0 0 0 0
  24635. 1.8678 1.4091 -0.3979 H 0 0 0 0 0 0 0 0 0 0 0 0
  24636. 1 2 2 0
  24637. 2 3 1 0
  24638. 3 4 2 0
  24639. 4 5 1 0
  24640. 5 6 2 0
  24641. 6 1 1 0
  24642. 1 7 1 0
  24643. 2 8 1 0
  24644. 3 9 1 0
  24645. 5 10 1 0
  24646. 6 11 1 0
  24647. M END
  24648. $$$$
  24649. RDKit 3D
  24650. 11 11 0 0 0 0 0 0 0 0999 V2000
  24651. -0.2702 1.1073 -0.3201 C 0 0 0 0 0 0 0 0 0 0 0 0
  24652. -1.2785 0.1841 -0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0
  24653. -0.9129 -1.0999 0.3078 C 0 0 0 0 0 0 0 0 0 0 0 0
  24654. 0.3682 -1.5089 0.4363 N 0 0 0 0 0 0 0 0 0 0 0 0
  24655. 1.3253 -0.5905 0.1809 C 0 0 0 0 0 0 0 0 0 0 0 0
  24656. 1.0589 0.7161 -0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0
  24657. -0.5180 2.1231 -0.6138 H 0 0 0 0 0 0 0 0 0 0 0 0
  24658. -2.3238 0.4575 -0.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
  24659. -1.6631 -1.8565 0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0
  24660. 2.3464 -0.9439 0.2911 H 0 0 0 0 0 0 0 0 0 0 0 0
  24661. 1.8678 1.4115 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0
  24662. 1 2 2 0
  24663. 2 3 1 0
  24664. 3 4 2 0
  24665. 4 5 1 0
  24666. 5 6 2 0
  24667. 6 1 1 0
  24668. 1 7 1 0
  24669. 2 8 1 0
  24670. 3 9 1 0
  24671. 5 10 1 0
  24672. 6 11 1 0
  24673. M END
  24674. $$$$
  24675. RDKit 3D
  24676. 11 11 0 0 0 0 0 0 0 0999 V2000
  24677. -0.2702 1.1093 -0.3132 C 0 0 0 0 0 0 0 0 0 0 0 0
  24678. -1.2785 0.1845 -0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0
  24679. -0.9129 -1.1018 0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0
  24680. 0.3682 -1.5116 0.4268 N 0 0 0 0 0 0 0 0 0 0 0 0
  24681. 1.3253 -0.5916 0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0
  24682. 1.0589 0.7173 -0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0
  24683. -0.5180 2.1270 -0.6005 H 0 0 0 0 0 0 0 0 0 0 0 0
  24684. -2.3238 0.4585 -0.1485 H 0 0 0 0 0 0 0 0 0 0 0 0
  24685. -1.6631 -1.8597 0.5068 H 0 0 0 0 0 0 0 0 0 0 0 0
  24686. 2.3464 -0.9457 0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0
  24687. 1.8678 1.4139 -0.3802 H 0 0 0 0 0 0 0 0 0 0 0 0
  24688. 1 2 2 0
  24689. 2 3 1 0
  24690. 3 4 2 0
  24691. 4 5 1 0
  24692. 5 6 2 0
  24693. 6 1 1 0
  24694. 1 7 1 0
  24695. 2 8 1 0
  24696. 3 9 1 0
  24697. 5 10 1 0
  24698. 6 11 1 0
  24699. M END
  24700. $$$$
  24701. RDKit 3D
  24702. 11 11 0 0 0 0 0 0 0 0999 V2000
  24703. -0.2702 1.1112 -0.3062 C 0 0 0 0 0 0 0 0 0 0 0 0
  24704. -1.2785 0.1849 -0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0
  24705. -0.9129 -1.1037 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0
  24706. 0.3682 -1.5143 0.4173 N 0 0 0 0 0 0 0 0 0 0 0 0
  24707. 1.3253 -0.5927 0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0
  24708. 1.0589 0.7185 -0.1874 C 0 0 0 0 0 0 0 0 0 0 0 0
  24709. -0.5180 2.1307 -0.5871 H 0 0 0 0 0 0 0 0 0 0 0 0
  24710. -2.3238 0.4594 -0.1456 H 0 0 0 0 0 0 0 0 0 0 0 0
  24711. -1.6631 -1.8629 0.4951 H 0 0 0 0 0 0 0 0 0 0 0 0
  24712. 2.3464 -0.9475 0.2793 H 0 0 0 0 0 0 0 0 0 0 0 0
  24713. 1.8678 1.4163 -0.3713 H 0 0 0 0 0 0 0 0 0 0 0 0
  24714. 1 2 2 0
  24715. 2 3 1 0
  24716. 3 4 2 0
  24717. 4 5 1 0
  24718. 5 6 2 0
  24719. 6 1 1 0
  24720. 1 7 1 0
  24721. 2 8 1 0
  24722. 3 9 1 0
  24723. 5 10 1 0
  24724. 6 11 1 0
  24725. M END
  24726. $$$$
  24727. RDKit 3D
  24728. 11 11 0 0 0 0 0 0 0 0999 V2000
  24729. -0.2702 1.1131 -0.2992 C 0 0 0 0 0 0 0 0 0 0 0 0
  24730. -1.2785 0.1853 -0.0604 C 0 0 0 0 0 0 0 0 0 0 0 0
  24731. -0.9129 -1.1055 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0
  24732. 0.3682 -1.5169 0.4077 N 0 0 0 0 0 0 0 0 0 0 0 0
  24733. 1.3253 -0.5938 0.1697 C 0 0 0 0 0 0 0 0 0 0 0 0
  24734. 1.0589 0.7197 -0.1829 C 0 0 0 0 0 0 0 0 0 0 0 0
  24735. -0.5180 2.1343 -0.5737 H 0 0 0 0 0 0 0 0 0 0 0 0
  24736. -2.3238 0.4603 -0.1427 H 0 0 0 0 0 0 0 0 0 0 0 0
  24737. -1.6631 -1.8659 0.4834 H 0 0 0 0 0 0 0 0 0 0 0 0
  24738. 2.3464 -0.9492 0.2733 H 0 0 0 0 0 0 0 0 0 0 0 0
  24739. 1.8678 1.4186 -0.3624 H 0 0 0 0 0 0 0 0 0 0 0 0
  24740. 1 2 2 0
  24741. 2 3 1 0
  24742. 3 4 2 0
  24743. 4 5 1 0
  24744. 5 6 2 0
  24745. 6 1 1 0
  24746. 1 7 1 0
  24747. 2 8 1 0
  24748. 3 9 1 0
  24749. 5 10 1 0
  24750. 6 11 1 0
  24751. M END
  24752. $$$$
  24753. RDKit 3D
  24754. 11 11 0 0 0 0 0 0 0 0999 V2000
  24755. -0.2702 1.1150 -0.2922 C 0 0 0 0 0 0 0 0 0 0 0 0
  24756. -1.2785 0.1856 -0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0
  24757. -0.9129 -1.1073 0.2801 C 0 0 0 0 0 0 0 0 0 0 0 0
  24758. 0.3682 -1.5194 0.3982 N 0 0 0 0 0 0 0 0 0 0 0 0
  24759. 1.3253 -0.5948 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0
  24760. 1.0589 0.7208 -0.1784 C 0 0 0 0 0 0 0 0 0 0 0 0
  24761. -0.5180 2.1379 -0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0
  24762. -2.3238 0.4612 -0.1398 H 0 0 0 0 0 0 0 0 0 0 0 0
  24763. -1.6631 -1.8689 0.4717 H 0 0 0 0 0 0 0 0 0 0 0 0
  24764. 2.3464 -0.9509 0.2673 H 0 0 0 0 0 0 0 0 0 0 0 0
  24765. 1.8678 1.4209 -0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0
  24766. 1 2 2 0
  24767. 2 3 1 0
  24768. 3 4 2 0
  24769. 4 5 1 0
  24770. 5 6 2 0
  24771. 6 1 1 0
  24772. 1 7 1 0
  24773. 2 8 1 0
  24774. 3 9 1 0
  24775. 5 10 1 0
  24776. 6 11 1 0
  24777. M END
  24778. $$$$
  24779. RDKit 3D
  24780. 11 11 0 0 0 0 0 0 0 0999 V2000
  24781. -0.2702 1.1168 -0.2852 C 0 0 0 0 0 0 0 0 0 0 0 0
  24782. -1.2785 0.1860 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
  24783. -0.9129 -1.1090 0.2731 C 0 0 0 0 0 0 0 0 0 0 0 0
  24784. 0.3682 -1.5219 0.3887 N 0 0 0 0 0 0 0 0 0 0 0 0
  24785. 1.3253 -0.5959 0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0
  24786. 1.0589 0.7219 -0.1738 C 0 0 0 0 0 0 0 0 0 0 0 0
  24787. -0.5180 2.1414 -0.5469 H 0 0 0 0 0 0 0 0 0 0 0 0
  24788. -2.3238 0.4620 -0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0
  24789. -1.6631 -1.8719 0.4599 H 0 0 0 0 0 0 0 0 0 0 0 0
  24790. 2.3464 -0.9526 0.2613 H 0 0 0 0 0 0 0 0 0 0 0 0
  24791. 1.8678 1.4231 -0.3445 H 0 0 0 0 0 0 0 0 0 0 0 0
  24792. 1 2 2 0
  24793. 2 3 1 0
  24794. 3 4 2 0
  24795. 4 5 1 0
  24796. 5 6 2 0
  24797. 6 1 1 0
  24798. 1 7 1 0
  24799. 2 8 1 0
  24800. 3 9 1 0
  24801. 5 10 1 0
  24802. 6 11 1 0
  24803. M END
  24804. $$$$
  24805. RDKit 3D
  24806. 11 11 0 0 0 0 0 0 0 0999 V2000
  24807. -0.2702 1.1186 -0.2782 C 0 0 0 0 0 0 0 0 0 0 0 0
  24808. -1.2785 0.1864 -0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0
  24809. -0.9129 -1.1107 0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0
  24810. 0.3682 -1.5243 0.3791 N 0 0 0 0 0 0 0 0 0 0 0 0
  24811. 1.3253 -0.5969 0.1585 C 0 0 0 0 0 0 0 0 0 0 0 0
  24812. 1.0589 0.7230 -0.1693 C 0 0 0 0 0 0 0 0 0 0 0 0
  24813. -0.5180 2.1448 -0.5334 H 0 0 0 0 0 0 0 0 0 0 0 0
  24814. -2.3238 0.4629 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
  24815. -1.6631 -1.8747 0.4482 H 0 0 0 0 0 0 0 0 0 0 0 0
  24816. 2.3464 -0.9542 0.2554 H 0 0 0 0 0 0 0 0 0 0 0 0
  24817. 1.8678 1.4252 -0.3356 H 0 0 0 0 0 0 0 0 0 0 0 0
  24818. 1 2 2 0
  24819. 2 3 1 0
  24820. 3 4 2 0
  24821. 4 5 1 0
  24822. 5 6 2 0
  24823. 6 1 1 0
  24824. 1 7 1 0
  24825. 2 8 1 0
  24826. 3 9 1 0
  24827. 5 10 1 0
  24828. 6 11 1 0
  24829. M END
  24830. $$$$
  24831. RDKit 3D
  24832. 11 11 0 0 0 0 0 0 0 0999 V2000
  24833. -0.2702 1.1203 -0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0
  24834. -1.2785 0.1867 -0.0557 C 0 0 0 0 0 0 0 0 0 0 0 0
  24835. -0.9129 -1.1124 0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0
  24836. 0.3682 -1.5266 0.3695 N 0 0 0 0 0 0 0 0 0 0 0 0
  24837. 1.3253 -0.5979 0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0
  24838. 1.0589 0.7240 -0.1647 C 0 0 0 0 0 0 0 0 0 0 0 0
  24839. -0.5180 2.1481 -0.5199 H 0 0 0 0 0 0 0 0 0 0 0 0
  24840. -2.3238 0.4637 -0.1311 H 0 0 0 0 0 0 0 0 0 0 0 0
  24841. -1.6631 -1.8775 0.4364 H 0 0 0 0 0 0 0 0 0 0 0 0
  24842. 2.3464 -0.9558 0.2494 H 0 0 0 0 0 0 0 0 0 0 0 0
  24843. 1.8678 1.4273 -0.3266 H 0 0 0 0 0 0 0 0 0 0 0 0
  24844. 1 2 2 0
  24845. 2 3 1 0
  24846. 3 4 2 0
  24847. 4 5 1 0
  24848. 5 6 2 0
  24849. 6 1 1 0
  24850. 1 7 1 0
  24851. 2 8 1 0
  24852. 3 9 1 0
  24853. 5 10 1 0
  24854. 6 11 1 0
  24855. M END
  24856. $$$$
  24857. RDKit 3D
  24858. 11 11 0 0 0 0 0 0 0 0999 V2000
  24859. -0.2702 1.1220 -0.2641 C 0 0 0 0 0 0 0 0 0 0 0 0
  24860. -1.2785 0.1871 -0.0545 C 0 0 0 0 0 0 0 0 0 0 0 0
  24861. -0.9129 -1.1140 0.2522 C 0 0 0 0 0 0 0 0 0 0 0 0
  24862. 0.3682 -1.5289 0.3599 N 0 0 0 0 0 0 0 0 0 0 0 0
  24863. 1.3253 -0.5988 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  24864. 1.0589 0.7251 -0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0
  24865. -0.5180 2.1513 -0.5064 H 0 0 0 0 0 0 0 0 0 0 0 0
  24866. -2.3238 0.4645 -0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0
  24867. -1.6631 -1.8802 0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0
  24868. 2.3464 -0.9573 0.2433 H 0 0 0 0 0 0 0 0 0 0 0 0
  24869. 1.8678 1.4293 -0.3176 H 0 0 0 0 0 0 0 0 0 0 0 0
  24870. 1 2 2 0
  24871. 2 3 1 0
  24872. 3 4 2 0
  24873. 4 5 1 0
  24874. 5 6 2 0
  24875. 6 1 1 0
  24876. 1 7 1 0
  24877. 2 8 1 0
  24878. 3 9 1 0
  24879. 5 10 1 0
  24880. 6 11 1 0
  24881. M END
  24882. $$$$
  24883. RDKit 3D
  24884. 11 11 0 0 0 0 0 0 0 0999 V2000
  24885. -0.2702 1.1236 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  24886. -1.2785 0.1874 -0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0
  24887. -0.9129 -1.1155 0.2452 C 0 0 0 0 0 0 0 0 0 0 0 0
  24888. 0.3682 -1.5312 0.3503 N 0 0 0 0 0 0 0 0 0 0 0 0
  24889. 1.3253 -0.5998 0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0
  24890. 1.0589 0.7261 -0.1556 C 0 0 0 0 0 0 0 0 0 0 0 0
  24891. -0.5180 2.1544 -0.4929 H 0 0 0 0 0 0 0 0 0 0 0 0
  24892. -2.3238 0.4653 -0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0
  24893. -1.6631 -1.8828 0.4128 H 0 0 0 0 0 0 0 0 0 0 0 0
  24894. 2.3464 -0.9589 0.2373 H 0 0 0 0 0 0 0 0 0 0 0 0
  24895. 1.8678 1.4313 -0.3086 H 0 0 0 0 0 0 0 0 0 0 0 0
  24896. 1 2 2 0
  24897. 2 3 1 0
  24898. 3 4 2 0
  24899. 4 5 1 0
  24900. 5 6 2 0
  24901. 6 1 1 0
  24902. 1 7 1 0
  24903. 2 8 1 0
  24904. 3 9 1 0
  24905. 5 10 1 0
  24906. 6 11 1 0
  24907. M END
  24908. $$$$
  24909. RDKit 3D
  24910. 11 11 0 0 0 0 0 0 0 0999 V2000
  24911. -0.2702 1.1252 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0
  24912. -1.2785 0.1877 -0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0
  24913. -0.9129 -1.1170 0.2382 C 0 0 0 0 0 0 0 0 0 0 0 0
  24914. 0.3682 -1.5333 0.3407 N 0 0 0 0 0 0 0 0 0 0 0 0
  24915. 1.3253 -0.6007 0.1435 C 0 0 0 0 0 0 0 0 0 0 0 0
  24916. 1.0589 0.7270 -0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0
  24917. -0.5180 2.1575 -0.4793 H 0 0 0 0 0 0 0 0 0 0 0 0
  24918. -2.3238 0.4661 -0.1223 H 0 0 0 0 0 0 0 0 0 0 0 0
  24919. -1.6631 -1.8854 0.4009 H 0 0 0 0 0 0 0 0 0 0 0 0
  24920. 2.3464 -0.9603 0.2313 H 0 0 0 0 0 0 0 0 0 0 0 0
  24921. 1.8678 1.4332 -0.2997 H 0 0 0 0 0 0 0 0 0 0 0 0
  24922. 1 2 2 0
  24923. 2 3 1 0
  24924. 3 4 2 0
  24925. 4 5 1 0
  24926. 5 6 2 0
  24927. 6 1 1 0
  24928. 1 7 1 0
  24929. 2 8 1 0
  24930. 3 9 1 0
  24931. 5 10 1 0
  24932. 6 11 1 0
  24933. M END
  24934. $$$$
  24935. RDKit 3D
  24936. 11 11 0 0 0 0 0 0 0 0999 V2000
  24937. -0.2702 1.1268 -0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0
  24938. -1.2785 0.1881 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0
  24939. -0.9129 -1.1185 0.2311 C 0 0 0 0 0 0 0 0 0 0 0 0
  24940. 0.3682 -1.5355 0.3310 N 0 0 0 0 0 0 0 0 0 0 0 0
  24941. 1.3253 -0.6016 0.1397 C 0 0 0 0 0 0 0 0 0 0 0 0
  24942. 1.0589 0.7280 -0.1465 C 0 0 0 0 0 0 0 0 0 0 0 0
  24943. -0.5180 2.1605 -0.4658 H 0 0 0 0 0 0 0 0 0 0 0 0
  24944. -2.3238 0.4669 -0.1194 H 0 0 0 0 0 0 0 0 0 0 0 0
  24945. -1.6631 -1.8879 0.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
  24946. 2.3464 -0.9618 0.2253 H 0 0 0 0 0 0 0 0 0 0 0 0
  24947. 1.8678 1.4350 -0.2906 H 0 0 0 0 0 0 0 0 0 0 0 0
  24948. 1 2 2 0
  24949. 2 3 1 0
  24950. 3 4 2 0
  24951. 4 5 1 0
  24952. 5 6 2 0
  24953. 6 1 1 0
  24954. 1 7 1 0
  24955. 2 8 1 0
  24956. 3 9 1 0
  24957. 5 10 1 0
  24958. 6 11 1 0
  24959. M END
  24960. $$$$
  24961. RDKit 3D
  24962. 11 11 0 0 0 0 0 0 0 0999 V2000
  24963. -0.2702 1.1283 -0.2358 C 0 0 0 0 0 0 0 0 0 0 0 0
  24964. -1.2785 0.1884 -0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
  24965. -0.9129 -1.1200 0.2241 C 0 0 0 0 0 0 0 0 0 0 0 0
  24966. 0.3682 -1.5375 0.3214 N 0 0 0 0 0 0 0 0 0 0 0 0
  24967. 1.3253 -0.6024 0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
  24968. 1.0589 0.7289 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0
  24969. -0.5180 2.1634 -0.4522 H 0 0 0 0 0 0 0 0 0 0 0 0
  24970. -2.3238 0.4676 -0.1164 H 0 0 0 0 0 0 0 0 0 0 0 0
  24971. -1.6631 -1.8903 0.3772 H 0 0 0 0 0 0 0 0 0 0 0 0
  24972. 2.3464 -0.9632 0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0
  24973. 1.8678 1.4368 -0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0
  24974. 1 2 2 0
  24975. 2 3 1 0
  24976. 3 4 2 0
  24977. 4 5 1 0
  24978. 5 6 2 0
  24979. 6 1 1 0
  24980. 1 7 1 0
  24981. 2 8 1 0
  24982. 3 9 1 0
  24983. 5 10 1 0
  24984. 6 11 1 0
  24985. M END
  24986. $$$$
  24987. RDKit 3D
  24988. 11 11 0 0 0 0 0 0 0 0999 V2000
  24989. -0.2702 1.1297 -0.2287 C 0 0 0 0 0 0 0 0 0 0 0 0
  24990. -1.2785 0.1887 -0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0
  24991. -0.9129 -1.1213 0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0
  24992. 0.3682 -1.5395 0.3117 N 0 0 0 0 0 0 0 0 0 0 0 0
  24993. 1.3253 -0.6033 0.1321 C 0 0 0 0 0 0 0 0 0 0 0 0
  24994. 1.0589 0.7297 -0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0
  24995. -0.5180 2.1662 -0.4386 H 0 0 0 0 0 0 0 0 0 0 0 0
  24996. -2.3238 0.4683 -0.1135 H 0 0 0 0 0 0 0 0 0 0 0 0
  24997. -1.6631 -1.8926 0.3653 H 0 0 0 0 0 0 0 0 0 0 0 0
  24998. 2.3464 -0.9645 0.2132 H 0 0 0 0 0 0 0 0 0 0 0 0
  24999. 1.8678 1.4386 -0.2726 H 0 0 0 0 0 0 0 0 0 0 0 0
  25000. 1 2 2 0
  25001. 2 3 1 0
  25002. 3 4 2 0
  25003. 4 5 1 0
  25004. 5 6 2 0
  25005. 6 1 1 0
  25006. 1 7 1 0
  25007. 2 8 1 0
  25008. 3 9 1 0
  25009. 5 10 1 0
  25010. 6 11 1 0
  25011. M END
  25012. $$$$
  25013. RDKit 3D
  25014. 11 11 0 0 0 0 0 0 0 0999 V2000
  25015. -0.2702 1.1311 -0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0
  25016. -1.2785 0.1890 -0.0474 C 0 0 0 0 0 0 0 0 0 0 0 0
  25017. -0.9129 -1.1227 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0
  25018. 0.3682 -1.5414 0.3020 N 0 0 0 0 0 0 0 0 0 0 0 0
  25019. 1.3253 -0.6041 0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0
  25020. 1.0589 0.7306 -0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0
  25021. -0.5180 2.1689 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0
  25022. -2.3238 0.4690 -0.1106 H 0 0 0 0 0 0 0 0 0 0 0 0
  25023. -1.6631 -1.8949 0.3534 H 0 0 0 0 0 0 0 0 0 0 0 0
  25024. 2.3464 -0.9658 0.2071 H 0 0 0 0 0 0 0 0 0 0 0 0
  25025. 1.8678 1.4403 -0.2635 H 0 0 0 0 0 0 0 0 0 0 0 0
  25026. 1 2 2 0
  25027. 2 3 1 0
  25028. 3 4 2 0
  25029. 4 5 1 0
  25030. 5 6 2 0
  25031. 6 1 1 0
  25032. 1 7 1 0
  25033. 2 8 1 0
  25034. 3 9 1 0
  25035. 5 10 1 0
  25036. 6 11 1 0
  25037. M END
  25038. $$$$
  25039. RDKit 3D
  25040. 11 11 0 0 0 0 0 0 0 0999 V2000
  25041. -0.2702 1.1325 -0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0
  25042. -1.2785 0.1893 -0.0462 C 0 0 0 0 0 0 0 0 0 0 0 0
  25043. -0.9129 -1.1240 0.2029 C 0 0 0 0 0 0 0 0 0 0 0 0
  25044. 0.3682 -1.5433 0.2923 N 0 0 0 0 0 0 0 0 0 0 0 0
  25045. 1.3253 -0.6049 0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0
  25046. 1.0589 0.7314 -0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0
  25047. -0.5180 2.1715 -0.4113 H 0 0 0 0 0 0 0 0 0 0 0 0
  25048. -2.3238 0.4697 -0.1076 H 0 0 0 0 0 0 0 0 0 0 0 0
  25049. -1.6631 -1.8970 0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0
  25050. 2.3464 -0.9671 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0
  25051. 1.8678 1.4419 -0.2545 H 0 0 0 0 0 0 0 0 0 0 0 0
  25052. 1 2 2 0
  25053. 2 3 1 0
  25054. 3 4 2 0
  25055. 4 5 1 0
  25056. 5 6 2 0
  25057. 6 1 1 0
  25058. 1 7 1 0
  25059. 2 8 1 0
  25060. 3 9 1 0
  25061. 5 10 1 0
  25062. 6 11 1 0
  25063. M END
  25064. $$$$
  25065. RDKit 3D
  25066. 11 11 0 0 0 0 0 0 0 0999 V2000
  25067. -0.2702 1.1338 -0.2074 C 0 0 0 0 0 0 0 0 0 0 0 0
  25068. -1.2785 0.1896 -0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0
  25069. -0.9129 -1.1252 0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0
  25070. 0.3682 -1.5451 0.2826 N 0 0 0 0 0 0 0 0 0 0 0 0
  25071. 1.3253 -0.6056 0.1207 C 0 0 0 0 0 0 0 0 0 0 0 0
  25072. 1.0589 0.7322 -0.1236 C 0 0 0 0 0 0 0 0 0 0 0 0
  25073. -0.5180 2.1740 -0.3977 H 0 0 0 0 0 0 0 0 0 0 0 0
  25074. -2.3238 0.4704 -0.1047 H 0 0 0 0 0 0 0 0 0 0 0 0
  25075. -1.6631 -1.8992 0.3296 H 0 0 0 0 0 0 0 0 0 0 0 0
  25076. 2.3464 -0.9684 0.1949 H 0 0 0 0 0 0 0 0 0 0 0 0
  25077. 1.8678 1.4435 -0.2454 H 0 0 0 0 0 0 0 0 0 0 0 0
  25078. 1 2 2 0
  25079. 2 3 1 0
  25080. 3 4 2 0
  25081. 4 5 1 0
  25082. 5 6 2 0
  25083. 6 1 1 0
  25084. 1 7 1 0
  25085. 2 8 1 0
  25086. 3 9 1 0
  25087. 5 10 1 0
  25088. 6 11 1 0
  25089. M END
  25090. $$$$
  25091. RDKit 3D
  25092. 11 11 0 0 0 0 0 0 0 0999 V2000
  25093. -0.2702 1.1351 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0
  25094. -1.2785 0.1899 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0
  25095. -0.9129 -1.1264 0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0
  25096. 0.3682 -1.5468 0.2729 N 0 0 0 0 0 0 0 0 0 0 0 0
  25097. 1.3253 -0.6064 0.1169 C 0 0 0 0 0 0 0 0 0 0 0 0
  25098. 1.0589 0.7330 -0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0
  25099. -0.5180 2.1765 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0
  25100. -2.3238 0.4710 -0.1017 H 0 0 0 0 0 0 0 0 0 0 0 0
  25101. -1.6631 -1.9012 0.3176 H 0 0 0 0 0 0 0 0 0 0 0 0
  25102. 2.3464 -0.9696 0.1888 H 0 0 0 0 0 0 0 0 0 0 0 0
  25103. 1.8678 1.4450 -0.2363 H 0 0 0 0 0 0 0 0 0 0 0 0
  25104. 1 2 2 0
  25105. 2 3 1 0
  25106. 3 4 2 0
  25107. 4 5 1 0
  25108. 5 6 2 0
  25109. 6 1 1 0
  25110. 1 7 1 0
  25111. 2 8 1 0
  25112. 3 9 1 0
  25113. 5 10 1 0
  25114. 6 11 1 0
  25115. M END
  25116. $$$$
  25117. RDKit 3D
  25118. 11 11 0 0 0 0 0 0 0 0999 V2000
  25119. -0.2702 1.1363 -0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0
  25120. -1.2785 0.1901 -0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0
  25121. -0.9129 -1.1276 0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0
  25122. 0.3682 -1.5485 0.2632 N 0 0 0 0 0 0 0 0 0 0 0 0
  25123. 1.3253 -0.6071 0.1131 C 0 0 0 0 0 0 0 0 0 0 0 0
  25124. 1.0589 0.7337 -0.1143 C 0 0 0 0 0 0 0 0 0 0 0 0
  25125. -0.5180 2.1789 -0.3703 H 0 0 0 0 0 0 0 0 0 0 0 0
  25126. -2.3238 0.4717 -0.0987 H 0 0 0 0 0 0 0 0 0 0 0 0
  25127. -1.6631 -1.9031 0.3057 H 0 0 0 0 0 0 0 0 0 0 0 0
  25128. 2.3464 -0.9707 0.1828 H 0 0 0 0 0 0 0 0 0 0 0 0
  25129. 1.8678 1.4464 -0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0
  25130. 1 2 2 0
  25131. 2 3 1 0
  25132. 3 4 2 0
  25133. 4 5 1 0
  25134. 5 6 2 0
  25135. 6 1 1 0
  25136. 1 7 1 0
  25137. 2 8 1 0
  25138. 3 9 1 0
  25139. 5 10 1 0
  25140. 6 11 1 0
  25141. M END
  25142. $$$$
  25143. RDKit 3D
  25144. 11 11 0 0 0 0 0 0 0 0999 V2000
  25145. -0.2702 1.1375 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  25146. -1.2785 0.1904 -0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0
  25147. -0.9129 -1.1287 0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
  25148. 0.3682 -1.5501 0.2535 N 0 0 0 0 0 0 0 0 0 0 0 0
  25149. 1.3253 -0.6078 0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0
  25150. 1.0589 0.7344 -0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0
  25151. -0.5180 2.1811 -0.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
  25152. -2.3238 0.4723 -0.0958 H 0 0 0 0 0 0 0 0 0 0 0 0
  25153. -1.6631 -1.9050 0.2937 H 0 0 0 0 0 0 0 0 0 0 0 0
  25154. 2.3464 -0.9719 0.1766 H 0 0 0 0 0 0 0 0 0 0 0 0
  25155. 1.8678 1.4478 -0.2182 H 0 0 0 0 0 0 0 0 0 0 0 0
  25156. 1 2 2 0
  25157. 2 3 1 0
  25158. 3 4 2 0
  25159. 4 5 1 0
  25160. 5 6 2 0
  25161. 6 1 1 0
  25162. 1 7 1 0
  25163. 2 8 1 0
  25164. 3 9 1 0
  25165. 5 10 1 0
  25166. 6 11 1 0
  25167. M END
  25168. $$$$
  25169. RDKit 3D
  25170. 11 11 0 0 0 0 0 0 0 0999 V2000
  25171. -0.2702 1.1387 -0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0
  25172. -1.2785 0.1906 -0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0
  25173. -0.9129 -1.1298 0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0
  25174. 0.3682 -1.5517 0.2437 N 0 0 0 0 0 0 0 0 0 0 0 0
  25175. 1.3253 -0.6085 0.1055 C 0 0 0 0 0 0 0 0 0 0 0 0
  25176. 1.0589 0.7351 -0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0
  25177. -0.5180 2.1833 -0.3429 H 0 0 0 0 0 0 0 0 0 0 0 0
  25178. -2.3238 0.4729 -0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0
  25179. -1.6631 -1.9068 0.2817 H 0 0 0 0 0 0 0 0 0 0 0 0
  25180. 2.3464 -0.9730 0.1705 H 0 0 0 0 0 0 0 0 0 0 0 0
  25181. 1.8678 1.4492 -0.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
  25182. 1 2 2 0
  25183. 2 3 1 0
  25184. 3 4 2 0
  25185. 4 5 1 0
  25186. 5 6 2 0
  25187. 6 1 1 0
  25188. 1 7 1 0
  25189. 2 8 1 0
  25190. 3 9 1 0
  25191. 5 10 1 0
  25192. 6 11 1 0
  25193. M END
  25194. $$$$
  25195. RDKit 3D
  25196. 11 11 0 0 0 0 0 0 0 0999 V2000
  25197. -0.2702 1.1398 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0
  25198. -1.2785 0.1909 -0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0
  25199. -0.9129 -1.1308 0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0
  25200. 0.3682 -1.5532 0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0
  25201. 1.3253 -0.6091 0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0
  25202. 1.0589 0.7357 -0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0
  25203. -0.5180 2.1855 -0.3292 H 0 0 0 0 0 0 0 0 0 0 0 0
  25204. -2.3238 0.4735 -0.0898 H 0 0 0 0 0 0 0 0 0 0 0 0
  25205. -1.6631 -1.9086 0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0
  25206. 2.3464 -0.9740 0.1644 H 0 0 0 0 0 0 0 0 0 0 0 0
  25207. 1.8678 1.4504 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  25208. 1 2 2 0
  25209. 2 3 1 0
  25210. 3 4 2 0
  25211. 4 5 1 0
  25212. 5 6 2 0
  25213. 6 1 1 0
  25214. 1 7 1 0
  25215. 2 8 1 0
  25216. 3 9 1 0
  25217. 5 10 1 0
  25218. 6 11 1 0
  25219. M END
  25220. $$$$
  25221. RDKit 3D
  25222. 11 11 0 0 0 0 0 0 0 0999 V2000
  25223. -0.2702 1.1408 -0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0
  25224. -1.2785 0.1911 -0.0379 C 0 0 0 0 0 0 0 0 0 0 0 0
  25225. -0.9129 -1.1318 0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0
  25226. 0.3682 -1.5546 0.2242 N 0 0 0 0 0 0 0 0 0 0 0 0
  25227. 1.3253 -0.6098 0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0
  25228. 1.0589 0.7363 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
  25229. -0.5180 2.1875 -0.3154 H 0 0 0 0 0 0 0 0 0 0 0 0
  25230. -2.3238 0.4740 -0.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
  25231. -1.6631 -1.9102 0.2578 H 0 0 0 0 0 0 0 0 0 0 0 0
  25232. 2.3464 -0.9750 0.1583 H 0 0 0 0 0 0 0 0 0 0 0 0
  25233. 1.8678 1.4517 -0.1908 H 0 0 0 0 0 0 0 0 0 0 0 0
  25234. 1 2 2 0
  25235. 2 3 1 0
  25236. 3 4 2 0
  25237. 4 5 1 0
  25238. 5 6 2 0
  25239. 6 1 1 0
  25240. 1 7 1 0
  25241. 2 8 1 0
  25242. 3 9 1 0
  25243. 5 10 1 0
  25244. 6 11 1 0
  25245. M END
  25246. $$$$
  25247. RDKit 3D
  25248. 11 11 0 0 0 0 0 0 0 0999 V2000
  25249. -0.2702 1.1419 -0.1573 C 0 0 0 0 0 0 0 0 0 0 0 0
  25250. -1.2785 0.1914 -0.0367 C 0 0 0 0 0 0 0 0 0 0 0 0
  25251. -0.9129 -1.1328 0.1462 C 0 0 0 0 0 0 0 0 0 0 0 0
  25252. 0.3682 -1.5560 0.2144 N 0 0 0 0 0 0 0 0 0 0 0 0
  25253. 1.3253 -0.6104 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
  25254. 1.0589 0.7369 -0.0912 C 0 0 0 0 0 0 0 0 0 0 0 0
  25255. -0.5180 2.1894 -0.3017 H 0 0 0 0 0 0 0 0 0 0 0 0
  25256. -2.3238 0.4745 -0.0839 H 0 0 0 0 0 0 0 0 0 0 0 0
  25257. -1.6631 -1.9118 0.2458 H 0 0 0 0 0 0 0 0 0 0 0 0
  25258. 2.3464 -0.9760 0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0
  25259. 1.8678 1.4528 -0.1817 H 0 0 0 0 0 0 0 0 0 0 0 0
  25260. 1 2 2 0
  25261. 2 3 1 0
  25262. 3 4 2 0
  25263. 4 5 1 0
  25264. 5 6 2 0
  25265. 6 1 1 0
  25266. 1 7 1 0
  25267. 2 8 1 0
  25268. 3 9 1 0
  25269. 5 10 1 0
  25270. 6 11 1 0
  25271. M END
  25272. $$$$
  25273. RDKit 3D
  25274. 11 11 0 0 0 0 0 0 0 0999 V2000
  25275. -0.2702 1.1428 -0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0
  25276. -1.2785 0.1916 -0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0
  25277. -0.9129 -1.1337 0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
  25278. 0.3682 -1.5573 0.2046 N 0 0 0 0 0 0 0 0 0 0 0 0
  25279. 1.3253 -0.6109 0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
  25280. 1.0589 0.7375 -0.0866 C 0 0 0 0 0 0 0 0 0 0 0 0
  25281. -0.5180 2.1913 -0.2879 H 0 0 0 0 0 0 0 0 0 0 0 0
  25282. -2.3238 0.4751 -0.0809 H 0 0 0 0 0 0 0 0 0 0 0 0
  25283. -1.6631 -1.9133 0.2337 H 0 0 0 0 0 0 0 0 0 0 0 0
  25284. 2.3464 -0.9769 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  25285. 1.8678 1.4540 -0.1726 H 0 0 0 0 0 0 0 0 0 0 0 0
  25286. 1 2 2 0
  25287. 2 3 1 0
  25288. 3 4 2 0
  25289. 4 5 1 0
  25290. 5 6 2 0
  25291. 6 1 1 0
  25292. 1 7 1 0
  25293. 2 8 1 0
  25294. 3 9 1 0
  25295. 5 10 1 0
  25296. 6 11 1 0
  25297. M END
  25298. $$$$
  25299. RDKit 3D
  25300. 11 11 0 0 0 0 0 0 0 0999 V2000
  25301. -0.2702 1.1437 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0
  25302. -1.2785 0.1918 -0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0
  25303. -0.9129 -1.1345 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0
  25304. 0.3682 -1.5586 0.1948 N 0 0 0 0 0 0 0 0 0 0 0 0
  25305. 1.3253 -0.6115 0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0
  25306. 1.0589 0.7380 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  25307. -0.5180 2.1930 -0.2742 H 0 0 0 0 0 0 0 0 0 0 0 0
  25308. -2.3238 0.4756 -0.0779 H 0 0 0 0 0 0 0 0 0 0 0 0
  25309. -1.6631 -1.9147 0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0
  25310. 2.3464 -0.9778 0.1399 H 0 0 0 0 0 0 0 0 0 0 0 0
  25311. 1.8678 1.4550 -0.1634 H 0 0 0 0 0 0 0 0 0 0 0 0
  25312. 1 2 2 0
  25313. 2 3 1 0
  25314. 3 4 2 0
  25315. 4 5 1 0
  25316. 5 6 2 0
  25317. 6 1 1 0
  25318. 1 7 1 0
  25319. 2 8 1 0
  25320. 3 9 1 0
  25321. 5 10 1 0
  25322. 6 11 1 0
  25323. M END
  25324. $$$$
  25325. RDKit 3D
  25326. 11 11 0 0 0 0 0 0 0 0999 V2000
  25327. -0.2702 1.1446 -0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0
  25328. -1.2785 0.1920 -0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0
  25329. -0.9129 -1.1353 0.1248 C 0 0 0 0 0 0 0 0 0 0 0 0
  25330. 0.3682 -1.5598 0.1850 N 0 0 0 0 0 0 0 0 0 0 0 0
  25331. 1.3253 -0.6120 0.0825 C 0 0 0 0 0 0 0 0 0 0 0 0
  25332. 1.0589 0.7385 -0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0
  25333. -0.5180 2.1947 -0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0
  25334. -2.3238 0.4760 -0.0749 H 0 0 0 0 0 0 0 0 0 0 0 0
  25335. -1.6631 -1.9161 0.2097 H 0 0 0 0 0 0 0 0 0 0 0 0
  25336. 2.3464 -0.9787 0.1337 H 0 0 0 0 0 0 0 0 0 0 0 0
  25337. 1.8678 1.4560 -0.1543 H 0 0 0 0 0 0 0 0 0 0 0 0
  25338. 1 2 2 0
  25339. 2 3 1 0
  25340. 3 4 2 0
  25341. 4 5 1 0
  25342. 5 6 2 0
  25343. 6 1 1 0
  25344. 1 7 1 0
  25345. 2 8 1 0
  25346. 3 9 1 0
  25347. 5 10 1 0
  25348. 6 11 1 0
  25349. M END
  25350. $$$$
  25351. RDKit 3D
  25352. 11 11 0 0 0 0 0 0 0 0999 V2000
  25353. -0.2702 1.1454 -0.1286 C 0 0 0 0 0 0 0 0 0 0 0 0
  25354. -1.2785 0.1922 -0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0
  25355. -0.9129 -1.1361 0.1177 C 0 0 0 0 0 0 0 0 0 0 0 0
  25356. 0.3682 -1.5609 0.1752 N 0 0 0 0 0 0 0 0 0 0 0 0
  25357. 1.3253 -0.6125 0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0
  25358. 1.0589 0.7390 -0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0
  25359. -0.5180 2.1963 -0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0
  25360. -2.3238 0.4765 -0.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
  25361. -1.6631 -1.9174 0.1976 H 0 0 0 0 0 0 0 0 0 0 0 0
  25362. 2.3464 -0.9795 0.1276 H 0 0 0 0 0 0 0 0 0 0 0 0
  25363. 1.8678 1.4570 -0.1452 H 0 0 0 0 0 0 0 0 0 0 0 0
  25364. 1 2 2 0
  25365. 2 3 1 0
  25366. 3 4 2 0
  25367. 4 5 1 0
  25368. 5 6 2 0
  25369. 6 1 1 0
  25370. 1 7 1 0
  25371. 2 8 1 0
  25372. 3 9 1 0
  25373. 5 10 1 0
  25374. 6 11 1 0
  25375. M END
  25376. $$$$
  25377. RDKit 3D
  25378. 11 11 0 0 0 0 0 0 0 0999 V2000
  25379. -0.2702 1.1462 -0.1214 C 0 0 0 0 0 0 0 0 0 0 0 0
  25380. -1.2785 0.1924 -0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0
  25381. -0.9129 -1.1368 0.1106 C 0 0 0 0 0 0 0 0 0 0 0 0
  25382. 0.3682 -1.5620 0.1654 N 0 0 0 0 0 0 0 0 0 0 0 0
  25383. 1.3253 -0.6130 0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
  25384. 1.0589 0.7394 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0
  25385. -0.5180 2.1978 -0.2328 H 0 0 0 0 0 0 0 0 0 0 0 0
  25386. -2.3238 0.4769 -0.0689 H 0 0 0 0 0 0 0 0 0 0 0 0
  25387. -1.6631 -1.9186 0.1856 H 0 0 0 0 0 0 0 0 0 0 0 0
  25388. 2.3464 -0.9803 0.1214 H 0 0 0 0 0 0 0 0 0 0 0 0
  25389. 1.8678 1.4578 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0
  25390. 1 2 2 0
  25391. 2 3 1 0
  25392. 3 4 2 0
  25393. 4 5 1 0
  25394. 5 6 2 0
  25395. 6 1 1 0
  25396. 1 7 1 0
  25397. 2 8 1 0
  25398. 3 9 1 0
  25399. 5 10 1 0
  25400. 6 11 1 0
  25401. M END
  25402. $$$$
  25403. RDKit 3D
  25404. 11 11 0 0 0 0 0 0 0 0999 V2000
  25405. -0.2702 1.1470 -0.1142 C 0 0 0 0 0 0 0 0 0 0 0 0
  25406. -1.2785 0.1926 -0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0
  25407. -0.9129 -1.1375 0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
  25408. 0.3682 -1.5630 0.1556 N 0 0 0 0 0 0 0 0 0 0 0 0
  25409. 1.3253 -0.6135 0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0
  25410. 1.0589 0.7398 -0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
  25411. -0.5180 2.1992 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0
  25412. -2.3238 0.4774 -0.0659 H 0 0 0 0 0 0 0 0 0 0 0 0
  25413. -1.6631 -1.9197 0.1735 H 0 0 0 0 0 0 0 0 0 0 0 0
  25414. 2.3464 -0.9810 0.1153 H 0 0 0 0 0 0 0 0 0 0 0 0
  25415. 1.8678 1.4587 -0.1268 H 0 0 0 0 0 0 0 0 0 0 0 0
  25416. 1 2 2 0
  25417. 2 3 1 0
  25418. 3 4 2 0
  25419. 4 5 1 0
  25420. 5 6 2 0
  25421. 6 1 1 0
  25422. 1 7 1 0
  25423. 2 8 1 0
  25424. 3 9 1 0
  25425. 5 10 1 0
  25426. 6 11 1 0
  25427. M END
  25428. $$$$
  25429. RDKit 3D
  25430. 11 11 0 0 0 0 0 0 0 0999 V2000
  25431. -0.2702 1.1477 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  25432. -1.2785 0.1928 -0.0282 C 0 0 0 0 0 0 0 0 0 0 0 0
  25433. -0.9129 -1.1381 0.0963 C 0 0 0 0 0 0 0 0 0 0 0 0
  25434. 0.3682 -1.5639 0.1458 N 0 0 0 0 0 0 0 0 0 0 0 0
  25435. 1.3253 -0.6139 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0
  25436. 1.0589 0.7402 -0.0587 C 0 0 0 0 0 0 0 0 0 0 0 0
  25437. -0.5180 2.2006 -0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0
  25438. -2.3238 0.4778 -0.0629 H 0 0 0 0 0 0 0 0 0 0 0 0
  25439. -1.6631 -1.9208 0.1615 H 0 0 0 0 0 0 0 0 0 0 0 0
  25440. 2.3464 -0.9817 0.1091 H 0 0 0 0 0 0 0 0 0 0 0 0
  25441. 1.8678 1.4594 -0.1177 H 0 0 0 0 0 0 0 0 0 0 0 0
  25442. 1 2 2 0
  25443. 2 3 1 0
  25444. 3 4 2 0
  25445. 4 5 1 0
  25446. 5 6 2 0
  25447. 6 1 1 0
  25448. 1 7 1 0
  25449. 2 8 1 0
  25450. 3 9 1 0
  25451. 5 10 1 0
  25452. 6 11 1 0
  25453. M END
  25454. $$$$
  25455. RDKit 3D
  25456. 11 11 0 0 0 0 0 0 0 0999 V2000
  25457. -0.2702 1.1483 -0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0
  25458. -1.2785 0.1930 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0
  25459. -0.9129 -1.1387 0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0
  25460. 0.3682 -1.5648 0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0
  25461. 1.3253 -0.6143 0.0632 C 0 0 0 0 0 0 0 0 0 0 0 0
  25462. 1.0589 0.7406 -0.0541 C 0 0 0 0 0 0 0 0 0 0 0 0
  25463. -0.5180 2.2018 -0.1913 H 0 0 0 0 0 0 0 0 0 0 0 0
  25464. -2.3238 0.4782 -0.0599 H 0 0 0 0 0 0 0 0 0 0 0 0
  25465. -1.6631 -1.9217 0.1494 H 0 0 0 0 0 0 0 0 0 0 0 0
  25466. 2.3464 -0.9824 0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0
  25467. 1.8678 1.4601 -0.1085 H 0 0 0 0 0 0 0 0 0 0 0 0
  25468. 1 2 2 0
  25469. 2 3 1 0
  25470. 3 4 2 0
  25471. 4 5 1 0
  25472. 5 6 2 0
  25473. 6 1 1 0
  25474. 1 7 1 0
  25475. 2 8 1 0
  25476. 3 9 1 0
  25477. 5 10 1 0
  25478. 6 11 1 0
  25479. M END
  25480. $$$$
  25481. RDKit 3D
  25482. 11 11 0 0 0 0 0 0 0 0999 V2000
  25483. -0.2702 1.1489 -0.0926 C 0 0 0 0 0 0 0 0 0 0 0 0
  25484. -1.2785 0.1931 -0.0258 C 0 0 0 0 0 0 0 0 0 0 0 0
  25485. -0.9129 -1.1392 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  25486. 0.3682 -1.5657 0.1261 N 0 0 0 0 0 0 0 0 0 0 0 0
  25487. 1.3253 -0.6147 0.0593 C 0 0 0 0 0 0 0 0 0 0 0 0
  25488. 1.0589 0.7409 -0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0
  25489. -0.5180 2.2030 -0.1775 H 0 0 0 0 0 0 0 0 0 0 0 0
  25490. -2.3238 0.4785 -0.0569 H 0 0 0 0 0 0 0 0 0 0 0 0
  25491. -1.6631 -1.9226 0.1373 H 0 0 0 0 0 0 0 0 0 0 0 0
  25492. 2.3464 -0.9830 0.0968 H 0 0 0 0 0 0 0 0 0 0 0 0
  25493. 1.8678 1.4608 -0.0993 H 0 0 0 0 0 0 0 0 0 0 0 0
  25494. 1 2 2 0
  25495. 2 3 1 0
  25496. 3 4 2 0
  25497. 4 5 1 0
  25498. 5 6 2 0
  25499. 6 1 1 0
  25500. 1 7 1 0
  25501. 2 8 1 0
  25502. 3 9 1 0
  25503. 5 10 1 0
  25504. 6 11 1 0
  25505. M END
  25506. $$$$
  25507. RDKit 3D
  25508. 11 11 0 0 0 0 0 0 0 0999 V2000
  25509. -0.2702 1.1495 -0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0
  25510. -1.2785 0.1933 -0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0
  25511. -0.9129 -1.1397 0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
  25512. 0.3682 -1.5664 0.1163 N 0 0 0 0 0 0 0 0 0 0 0 0
  25513. 1.3253 -0.6151 0.0555 C 0 0 0 0 0 0 0 0 0 0 0 0
  25514. 1.0589 0.7412 -0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0
  25515. -0.5180 2.2040 -0.1636 H 0 0 0 0 0 0 0 0 0 0 0 0
  25516. -2.3238 0.4789 -0.0539 H 0 0 0 0 0 0 0 0 0 0 0 0
  25517. -1.6631 -1.9235 0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0
  25518. 2.3464 -0.9836 0.0906 H 0 0 0 0 0 0 0 0 0 0 0 0
  25519. 1.8678 1.4614 -0.0901 H 0 0 0 0 0 0 0 0 0 0 0 0
  25520. 1 2 2 0
  25521. 2 3 1 0
  25522. 3 4 2 0
  25523. 4 5 1 0
  25524. 5 6 2 0
  25525. 6 1 1 0
  25526. 1 7 1 0
  25527. 2 8 1 0
  25528. 3 9 1 0
  25529. 5 10 1 0
  25530. 6 11 1 0
  25531. M END
  25532. $$$$
  25533. RDKit 3D
  25534. 11 11 0 0 0 0 0 0 0 0999 V2000
  25535. -0.2702 1.1500 -0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
  25536. -1.2785 0.1934 -0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0
  25537. -0.9129 -1.1401 0.0676 C 0 0 0 0 0 0 0 0 0 0 0 0
  25538. 0.3682 -1.5671 0.1064 N 0 0 0 0 0 0 0 0 0 0 0 0
  25539. 1.3253 -0.6154 0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0
  25540. 1.0589 0.7415 -0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0
  25541. -0.5180 2.2050 -0.1498 H 0 0 0 0 0 0 0 0 0 0 0 0
  25542. -2.3238 0.4792 -0.0509 H 0 0 0 0 0 0 0 0 0 0 0 0
  25543. -1.6631 -1.9242 0.1131 H 0 0 0 0 0 0 0 0 0 0 0 0
  25544. 2.3464 -0.9842 0.0844 H 0 0 0 0 0 0 0 0 0 0 0 0
  25545. 1.8678 1.4619 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0
  25546. 1 2 2 0
  25547. 2 3 1 0
  25548. 3 4 2 0
  25549. 4 5 1 0
  25550. 5 6 2 0
  25551. 6 1 1 0
  25552. 1 7 1 0
  25553. 2 8 1 0
  25554. 3 9 1 0
  25555. 5 10 1 0
  25556. 6 11 1 0
  25557. M END
  25558. $$$$
  25559. RDKit 3D
  25560. 11 11 0 0 0 0 0 0 0 0999 V2000
  25561. -0.2702 1.1505 -0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0
  25562. -1.2785 0.1936 -0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0
  25563. -0.9129 -1.1406 0.0605 C 0 0 0 0 0 0 0 0 0 0 0 0
  25564. 0.3682 -1.5678 0.0966 N 0 0 0 0 0 0 0 0 0 0 0 0
  25565. 1.3253 -0.6157 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0
  25566. 1.0589 0.7417 -0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0
  25567. -0.5180 2.2059 -0.1359 H 0 0 0 0 0 0 0 0 0 0 0 0
  25568. -2.3238 0.4795 -0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0
  25569. -1.6631 -1.9249 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  25570. 2.3464 -0.9847 0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0
  25571. 1.8678 1.4624 -0.0718 H 0 0 0 0 0 0 0 0 0 0 0 0
  25572. 1 2 2 0
  25573. 2 3 1 0
  25574. 3 4 2 0
  25575. 4 5 1 0
  25576. 5 6 2 0
  25577. 6 1 1 0
  25578. 1 7 1 0
  25579. 2 8 1 0
  25580. 3 9 1 0
  25581. 5 10 1 0
  25582. 6 11 1 0
  25583. M END
  25584. $$$$
  25585. RDKit 3D
  25586. 11 11 0 0 0 0 0 0 0 0999 V2000
  25587. -0.2702 1.1509 -0.0637 C 0 0 0 0 0 0 0 0 0 0 0 0
  25588. -1.2785 0.1937 -0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0
  25589. -0.9129 -1.1409 0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0
  25590. 0.3682 -1.5683 0.0867 N 0 0 0 0 0 0 0 0 0 0 0 0
  25591. 1.3253 -0.6160 0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0
  25592. 1.0589 0.7419 -0.0308 C 0 0 0 0 0 0 0 0 0 0 0 0
  25593. -0.5180 2.2067 -0.1221 H 0 0 0 0 0 0 0 0 0 0 0 0
  25594. -2.3238 0.4798 -0.0449 H 0 0 0 0 0 0 0 0 0 0 0 0
  25595. -1.6631 -1.9255 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0
  25596. 2.3464 -0.9852 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0
  25597. 1.8678 1.4628 -0.0626 H 0 0 0 0 0 0 0 0 0 0 0 0
  25598. 1 2 2 0
  25599. 2 3 1 0
  25600. 3 4 2 0
  25601. 4 5 1 0
  25602. 5 6 2 0
  25603. 6 1 1 0
  25604. 1 7 1 0
  25605. 2 8 1 0
  25606. 3 9 1 0
  25607. 5 10 1 0
  25608. 6 11 1 0
  25609. M END
  25610. $$$$
  25611. RDKit 3D
  25612. 11 11 0 0 0 0 0 0 0 0999 V2000
  25613. -0.2702 1.1513 -0.0564 C 0 0 0 0 0 0 0 0 0 0 0 0
  25614. -1.2785 0.1939 -0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0
  25615. -0.9129 -1.1412 0.0461 C 0 0 0 0 0 0 0 0 0 0 0 0
  25616. 0.3682 -1.5688 0.0769 N 0 0 0 0 0 0 0 0 0 0 0 0
  25617. 1.3253 -0.6163 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  25618. 1.0589 0.7421 -0.0261 C 0 0 0 0 0 0 0 0 0 0 0 0
  25619. -0.5180 2.2075 -0.1082 H 0 0 0 0 0 0 0 0 0 0 0 0
  25620. -2.3238 0.4801 -0.0419 H 0 0 0 0 0 0 0 0 0 0 0 0
  25621. -1.6631 -1.9260 0.0769 H 0 0 0 0 0 0 0 0 0 0 0 0
  25622. 2.3464 -0.9856 0.0658 H 0 0 0 0 0 0 0 0 0 0 0 0
  25623. 1.8678 1.4632 -0.0534 H 0 0 0 0 0 0 0 0 0 0 0 0
  25624. 1 2 2 0
  25625. 2 3 1 0
  25626. 3 4 2 0
  25627. 4 5 1 0
  25628. 5 6 2 0
  25629. 6 1 1 0
  25630. 1 7 1 0
  25631. 2 8 1 0
  25632. 3 9 1 0
  25633. 5 10 1 0
  25634. 6 11 1 0
  25635. M END
  25636. $$$$
  25637. RDKit 3D
  25638. 11 11 0 0 0 0 0 0 0 0999 V2000
  25639. -0.2702 1.1516 -0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0
  25640. -1.2785 0.1940 -0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0
  25641. -0.9129 -1.1415 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
  25642. 0.3682 -1.5693 0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0
  25643. 1.3253 -0.6165 0.0361 C 0 0 0 0 0 0 0 0 0 0 0 0
  25644. 1.0589 0.7422 -0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0
  25645. -0.5180 2.2081 -0.0943 H 0 0 0 0 0 0 0 0 0 0 0 0
  25646. -2.3238 0.4803 -0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0
  25647. -1.6631 -1.9264 0.0647 H 0 0 0 0 0 0 0 0 0 0 0 0
  25648. 2.3464 -0.9860 0.0596 H 0 0 0 0 0 0 0 0 0 0 0 0
  25649. 1.8678 1.4635 -0.0442 H 0 0 0 0 0 0 0 0 0 0 0 0
  25650. 1 2 2 0
  25651. 2 3 1 0
  25652. 3 4 2 0
  25653. 4 5 1 0
  25654. 5 6 2 0
  25655. 6 1 1 0
  25656. 1 7 1 0
  25657. 2 8 1 0
  25658. 3 9 1 0
  25659. 5 10 1 0
  25660. 6 11 1 0
  25661. M END
  25662. $$$$
  25663. RDKit 3D
  25664. 11 11 0 0 0 0 0 0 0 0999 V2000
  25665. -0.2702 1.1519 -0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0
  25666. -1.2785 0.1941 -0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0
  25667. -0.9129 -1.1417 0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0
  25668. 0.3682 -1.5697 0.0572 N 0 0 0 0 0 0 0 0 0 0 0 0
  25669. 1.3253 -0.6167 0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0
  25670. 1.0589 0.7424 -0.0168 C 0 0 0 0 0 0 0 0 0 0 0 0
  25671. -0.5180 2.2086 -0.0804 H 0 0 0 0 0 0 0 0 0 0 0 0
  25672. -2.3238 0.4806 -0.0358 H 0 0 0 0 0 0 0 0 0 0 0 0
  25673. -1.6631 -1.9268 0.0526 H 0 0 0 0 0 0 0 0 0 0 0 0
  25674. 2.3464 -0.9863 0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0
  25675. 1.8678 1.4637 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
  25676. 1 2 2 0
  25677. 2 3 1 0
  25678. 3 4 2 0
  25679. 4 5 1 0
  25680. 5 6 2 0
  25681. 6 1 1 0
  25682. 1 7 1 0
  25683. 2 8 1 0
  25684. 3 9 1 0
  25685. 5 10 1 0
  25686. 6 11 1 0
  25687. M END
  25688. $$$$
  25689. RDKit 3D
  25690. 11 11 0 0 0 0 0 0 0 0999 V2000
  25691. -0.2702 1.1521 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0
  25692. -1.2785 0.1942 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0
  25693. -0.9129 -1.1419 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0
  25694. 0.3682 -1.5700 0.0473 N 0 0 0 0 0 0 0 0 0 0 0 0
  25695. 1.3253 -0.6169 0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0
  25696. 1.0589 0.7424 -0.0122 C 0 0 0 0 0 0 0 0 0 0 0 0
  25697. -0.5180 2.2091 -0.0666 H 0 0 0 0 0 0 0 0 0 0 0 0
  25698. -2.3238 0.4808 -0.0328 H 0 0 0 0 0 0 0 0 0 0 0 0
  25699. -1.6631 -1.9271 0.0405 H 0 0 0 0 0 0 0 0 0 0 0 0
  25700. 2.3464 -0.9867 0.0473 H 0 0 0 0 0 0 0 0 0 0 0 0
  25701. 1.8678 1.4639 -0.0258 H 0 0 0 0 0 0 0 0 0 0 0 0
  25702. 1 2 2 0
  25703. 2 3 1 0
  25704. 3 4 2 0
  25705. 4 5 1 0
  25706. 5 6 2 0
  25707. 6 1 1 0
  25708. 1 7 1 0
  25709. 2 8 1 0
  25710. 3 9 1 0
  25711. 5 10 1 0
  25712. 6 11 1 0
  25713. M END
  25714. $$$$
  25715. RDKit 3D
  25716. 11 11 0 0 0 0 0 0 0 0999 V2000
  25717. -0.2702 1.1523 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0
  25718. -1.2785 0.1943 -0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0
  25719. -0.9129 -1.1420 0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0
  25720. 0.3682 -1.5703 0.0374 N 0 0 0 0 0 0 0 0 0 0 0 0
  25721. 1.3253 -0.6171 0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0
  25722. 1.0589 0.7425 -0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0
  25723. -0.5180 2.2095 -0.0527 H 0 0 0 0 0 0 0 0 0 0 0 0
  25724. -2.3238 0.4810 -0.0298 H 0 0 0 0 0 0 0 0 0 0 0 0
  25725. -1.6631 -1.9273 0.0284 H 0 0 0 0 0 0 0 0 0 0 0 0
  25726. 2.3464 -0.9869 0.0411 H 0 0 0 0 0 0 0 0 0 0 0 0
  25727. 1.8678 1.4641 -0.0166 H 0 0 0 0 0 0 0 0 0 0 0 0
  25728. 1 2 2 0
  25729. 2 3 1 0
  25730. 3 4 2 0
  25731. 4 5 1 0
  25732. 5 6 2 0
  25733. 6 1 1 0
  25734. 1 7 1 0
  25735. 2 8 1 0
  25736. 3 9 1 0
  25737. 5 10 1 0
  25738. 6 11 1 0
  25739. M END
  25740. $$$$
  25741. RDKit 3D
  25742. 11 11 0 0 0 0 0 0 0 0999 V2000
  25743. -0.2702 1.1525 -0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0
  25744. -1.2785 0.1944 -0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0
  25745. -0.9129 -1.1421 0.0103 C 0 0 0 0 0 0 0 0 0 0 0 0
  25746. 0.3682 -1.5705 0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0
  25747. 1.3253 -0.6172 0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0
  25748. 1.0589 0.7425 -0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
  25749. -0.5180 2.2098 -0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0
  25750. -2.3238 0.4812 -0.0268 H 0 0 0 0 0 0 0 0 0 0 0 0
  25751. -1.6631 -1.9275 0.0163 H 0 0 0 0 0 0 0 0 0 0 0 0
  25752. 2.3464 -0.9872 0.0348 H 0 0 0 0 0 0 0 0 0 0 0 0
  25753. 1.8678 1.4641 -0.0074 H 0 0 0 0 0 0 0 0 0 0 0 0
  25754. 1 2 2 0
  25755. 2 3 1 0
  25756. 3 4 2 0
  25757. 4 5 1 0
  25758. 5 6 2 0
  25759. 6 1 1 0
  25760. 1 7 1 0
  25761. 2 8 1 0
  25762. 3 9 1 0
  25763. 5 10 1 0
  25764. 6 11 1 0
  25765. M END
  25766. $$$$
  25767. RDKit 3D
  25768. 11 11 0 0 0 0 0 0 0 0999 V2000
  25769. -0.2702 1.1526 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0
  25770. -1.2785 0.1945 -0.0124 C 0 0 0 0 0 0 0 0 0 0 0 0
  25771. -0.9129 -1.1421 0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0
  25772. 0.3682 -1.5706 0.0177 N 0 0 0 0 0 0 0 0 0 0 0 0
  25773. 1.3253 -0.6173 0.0167 C 0 0 0 0 0 0 0 0 0 0 0 0
  25774. 1.0589 0.7425 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0
  25775. -0.5180 2.2100 -0.0249 H 0 0 0 0 0 0 0 0 0 0 0 0
  25776. -2.3238 0.4813 -0.0237 H 0 0 0 0 0 0 0 0 0 0 0 0
  25777. -1.6631 -1.9275 0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0
  25778. 2.3464 -0.9874 0.0286 H 0 0 0 0 0 0 0 0 0 0 0 0
  25779. 1.8678 1.4642 0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0
  25780. 1 2 2 0
  25781. 2 3 1 0
  25782. 3 4 2 0
  25783. 4 5 1 0
  25784. 5 6 2 0
  25785. 6 1 1 0
  25786. 1 7 1 0
  25787. 2 8 1 0
  25788. 3 9 1 0
  25789. 5 10 1 0
  25790. 6 11 1 0
  25791. M END
  25792. $$$$
  25793. RDKit 3D
  25794. 11 11 0 0 0 0 0 0 0 0999 V2000
  25795. -0.2702 1.1526 -0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0
  25796. -1.2785 0.1945 -0.0112 C 0 0 0 0 0 0 0 0 0 0 0 0
  25797. -0.9129 -1.1421 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0
  25798. 0.3682 -1.5707 0.0078 N 0 0 0 0 0 0 0 0 0 0 0 0
  25799. 1.3253 -0.6174 0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0
  25800. 1.0589 0.7425 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
  25801. -0.5180 2.2101 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  25802. -2.3238 0.4815 -0.0207 H 0 0 0 0 0 0 0 0 0 0 0 0
  25803. -1.6631 -1.9275 -0.0079 H 0 0 0 0 0 0 0 0 0 0 0 0
  25804. 2.3464 -0.9875 0.0224 H 0 0 0 0 0 0 0 0 0 0 0 0
  25805. 1.8678 1.4641 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  25806. 1 2 2 0
  25807. 2 3 1 0
  25808. 3 4 2 0
  25809. 4 5 1 0
  25810. 5 6 2 0
  25811. 6 1 1 0
  25812. 1 7 1 0
  25813. 2 8 1 0
  25814. 3 9 1 0
  25815. 5 10 1 0
  25816. 6 11 1 0
  25817. M END
  25818. $$$$
  25819. RDKit 3D
  25820. 11 11 0 0 0 0 0 0 0 0999 V2000
  25821. -0.2702 1.1526 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0
  25822. -1.2785 0.1946 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0
  25823. -0.9129 -1.1421 -0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0
  25824. 0.3682 -1.5707 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0
  25825. 1.3253 -0.6175 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  25826. 1.0589 0.7425 0.0112 C 0 0 0 0 0 0 0 0 0 0 0 0
  25827. -0.5180 2.2101 0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0
  25828. -2.3238 0.4816 -0.0177 H 0 0 0 0 0 0 0 0 0 0 0 0
  25829. -1.6631 -1.9274 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0
  25830. 2.3464 -0.9877 0.0162 H 0 0 0 0 0 0 0 0 0 0 0 0
  25831. 1.8678 1.4640 0.0202 H 0 0 0 0 0 0 0 0 0 0 0 0
  25832. 1 2 2 0
  25833. 2 3 1 0
  25834. 3 4 2 0
  25835. 4 5 1 0
  25836. 5 6 2 0
  25837. 6 1 1 0
  25838. 1 7 1 0
  25839. 2 8 1 0
  25840. 3 9 1 0
  25841. 5 10 1 0
  25842. 6 11 1 0
  25843. M END
  25844. $$$$
  25845. RDKit 3D
  25846. 11 11 0 0 0 0 0 0 0 0999 V2000
  25847. -0.2702 1.1526 0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
  25848. -1.2785 0.1947 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
  25849. -0.9129 -1.1420 -0.0184 C 0 0 0 0 0 0 0 0 0 0 0 0
  25850. 0.3682 -1.5707 -0.0119 N 0 0 0 0 0 0 0 0 0 0 0 0
  25851. 1.3253 -0.6175 0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0
  25852. 1.0589 0.7424 0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
  25853. -0.5180 2.2100 0.0167 H 0 0 0 0 0 0 0 0 0 0 0 0
  25854. -2.3238 0.4817 -0.0147 H 0 0 0 0 0 0 0 0 0 0 0 0
  25855. -1.6631 -1.9273 -0.0321 H 0 0 0 0 0 0 0 0 0 0 0 0
  25856. 2.3464 -0.9877 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  25857. 1.8678 1.4639 0.0294 H 0 0 0 0 0 0 0 0 0 0 0 0
  25858. 1 2 2 0
  25859. 2 3 1 0
  25860. 3 4 2 0
  25861. 4 5 1 0
  25862. 5 6 2 0
  25863. 6 1 1 0
  25864. 1 7 1 0
  25865. 2 8 1 0
  25866. 3 9 1 0
  25867. 5 10 1 0
  25868. 6 11 1 0
  25869. M END
  25870. $$$$
  25871. RDKit 3D
  25872. 11 11 0 0 0 0 0 0 0 0999 V2000
  25873. -0.2702 1.1525 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0
  25874. -1.2785 0.1947 -0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0
  25875. -0.9129 -1.1419 -0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0
  25876. 0.3682 -1.5706 -0.0218 N 0 0 0 0 0 0 0 0 0 0 0 0
  25877. 1.3253 -0.6176 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
  25878. 1.0589 0.7423 0.0205 C 0 0 0 0 0 0 0 0 0 0 0 0
  25879. -0.5180 2.2099 0.0306 H 0 0 0 0 0 0 0 0 0 0 0 0
  25880. -2.3238 0.4818 -0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0
  25881. -1.6631 -1.9270 -0.0442 H 0 0 0 0 0 0 0 0 0 0 0 0
  25882. 2.3464 -0.9878 0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
  25883. 1.8678 1.4637 0.0386 H 0 0 0 0 0 0 0 0 0 0 0 0
  25884. 1 2 2 0
  25885. 2 3 1 0
  25886. 3 4 2 0
  25887. 4 5 1 0
  25888. 5 6 2 0
  25889. 6 1 1 0
  25890. 1 7 1 0
  25891. 2 8 1 0
  25892. 3 9 1 0
  25893. 5 10 1 0
  25894. 6 11 1 0
  25895. M END
  25896. $$$$
  25897. RDKit 3D
  25898. 11 11 0 0 0 0 0 0 0 0999 V2000
  25899. -0.2702 1.1524 0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0
  25900. -1.2785 0.1948 -0.0063 C 0 0 0 0 0 0 0 0 0 0 0 0
  25901. -0.9129 -1.1417 -0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0
  25902. 0.3682 -1.5704 -0.0316 N 0 0 0 0 0 0 0 0 0 0 0 0
  25903. 1.3253 -0.6176 -0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0
  25904. 1.0589 0.7421 0.0252 C 0 0 0 0 0 0 0 0 0 0 0 0
  25905. -0.5180 2.2097 0.0445 H 0 0 0 0 0 0 0 0 0 0 0 0
  25906. -2.3238 0.4818 -0.0086 H 0 0 0 0 0 0 0 0 0 0 0 0
  25907. -1.6631 -1.9267 -0.0563 H 0 0 0 0 0 0 0 0 0 0 0 0
  25908. 2.3464 -0.9878 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0
  25909. 1.8678 1.4634 0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0
  25910. 1 2 2 0
  25911. 2 3 1 0
  25912. 3 4 2 0
  25913. 4 5 1 0
  25914. 5 6 2 0
  25915. 6 1 1 0
  25916. 1 7 1 0
  25917. 2 8 1 0
  25918. 3 9 1 0
  25919. 5 10 1 0
  25920. 6 11 1 0
  25921. M END
  25922. $$$$
  25923. RDKit 3D
  25924. 11 11 0 0 0 0 0 0 0 0999 V2000
  25925. -0.2702 1.1522 0.0305 C 0 0 0 0 0 0 0 0 0 0 0 0
  25926. -1.2785 0.1948 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0
  25927. -0.9129 -1.1415 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  25928. 0.3682 -1.5702 -0.0415 N 0 0 0 0 0 0 0 0 0 0 0 0
  25929. 1.3253 -0.6175 -0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
  25930. 1.0589 0.7419 0.0298 C 0 0 0 0 0 0 0 0 0 0 0 0
  25931. -0.5180 2.2093 0.0584 H 0 0 0 0 0 0 0 0 0 0 0 0
  25932. -2.3238 0.4819 -0.0056 H 0 0 0 0 0 0 0 0 0 0 0 0
  25933. -1.6631 -1.9263 -0.0684 H 0 0 0 0 0 0 0 0 0 0 0 0
  25934. 2.3464 -0.9877 -0.0086 H 0 0 0 0 0 0 0 0 0 0 0 0
  25935. 1.8678 1.4631 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0
  25936. 1 2 2 0
  25937. 2 3 1 0
  25938. 3 4 2 0
  25939. 4 5 1 0
  25940. 5 6 2 0
  25941. 6 1 1 0
  25942. 1 7 1 0
  25943. 2 8 1 0
  25944. 3 9 1 0
  25945. 5 10 1 0
  25946. 6 11 1 0
  25947. M END
  25948. $$$$
  25949. RDKit 3D
  25950. 11 11 0 0 0 0 0 0 0 0999 V2000
  25951. -0.2702 1.1520 0.0377 C 0 0 0 0 0 0 0 0 0 0 0 0
  25952. -1.2785 0.1948 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
  25953. -0.9129 -1.1412 -0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
  25954. 0.3682 -1.5699 -0.0514 N 0 0 0 0 0 0 0 0 0 0 0 0
  25955. 1.3253 -0.6175 -0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0
  25956. 1.0589 0.7417 0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0
  25957. -0.5180 2.2089 0.0723 H 0 0 0 0 0 0 0 0 0 0 0 0
  25958. -2.3238 0.4819 -0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
  25959. -1.6631 -1.9259 -0.0805 H 0 0 0 0 0 0 0 0 0 0 0 0
  25960. 2.3464 -0.9877 -0.0148 H 0 0 0 0 0 0 0 0 0 0 0 0
  25961. 1.8678 1.4627 0.0662 H 0 0 0 0 0 0 0 0 0 0 0 0
  25962. 1 2 2 0
  25963. 2 3 1 0
  25964. 3 4 2 0
  25965. 4 5 1 0
  25966. 5 6 2 0
  25967. 6 1 1 0
  25968. 1 7 1 0
  25969. 2 8 1 0
  25970. 3 9 1 0
  25971. 5 10 1 0
  25972. 6 11 1 0
  25973. M END
  25974. $$$$
  25975. RDKit 3D
  25976. 11 11 0 0 0 0 0 0 0 0999 V2000
  25977. -0.2702 1.1518 0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0
  25978. -1.2785 0.1948 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0
  25979. -0.9129 -1.1409 -0.0543 C 0 0 0 0 0 0 0 0 0 0 0 0
  25980. 0.3682 -1.5695 -0.0612 N 0 0 0 0 0 0 0 0 0 0 0 0
  25981. 1.3253 -0.6174 -0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0
  25982. 1.0589 0.7415 0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0
  25983. -0.5180 2.2084 0.0862 H 0 0 0 0 0 0 0 0 0 0 0 0
  25984. -2.3238 0.4819 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
  25985. -1.6631 -1.9253 -0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0
  25986. 2.3464 -0.9876 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
  25987. 1.8678 1.4622 0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0
  25988. 1 2 2 0
  25989. 2 3 1 0
  25990. 3 4 2 0
  25991. 4 5 1 0
  25992. 5 6 2 0
  25993. 6 1 1 0
  25994. 1 7 1 0
  25995. 2 8 1 0
  25996. 3 9 1 0
  25997. 5 10 1 0
  25998. 6 11 1 0
  25999. M END
  26000. $$$$