TmMolStar/examples/sp-ido40.mol2

@<TRIPOS>MOLECULE
ZINC12921206_1
 49 52 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1 C1          0.6216   -0.2760   -6.8683 C.ar    1  <1>        -0.0541
      2 C2          0.3683   -0.8994   -5.6124 C.ar    1  <1>        -0.0469
      3 C3         -0.4563   -9.3380   -7.8499 C.ar    1  <1>        -0.0116
      4 C4         -1.3323   -7.7730   -5.7131 C.ar    1  <1>         0.0052
      5 C5          1.6788    0.6049   -6.8049 C.ar    1  <1>        -0.0237
      6 C6          1.0293   -0.0678   -2.1894 C.ar    1  <1>        -0.0133
      7 C7          1.2229   -0.9407   -3.2374 C.ar    1  <1>         0.0102
      8 C8          1.3908   -2.2806   -2.7857 C.ar    1  <1>         0.0803
      9 C9          0.4711   -8.6946   -7.0304 C.ar    1  <1>        -0.0256
     10 C10         0.0332   -7.9122   -5.9620 C.ar    1  <1>         0.0401
     11 C11        -1.8217   -9.1987   -7.6011 C.ar    1  <1>         0.1619
     12 C12        -2.2597   -8.4163   -6.5327 C.ar    1  <1>         0.1633
     13 C13         1.2418   -0.4712   -4.6368 C.ar    1  <1>         0.0206
     14 C14         1.3196   -2.3849   -1.4088 C.ar    1  <1>         0.1157
     15 C15         1.6389   -4.5865   -1.3837 C.ar    1  <1>         0.1003
     16 C16         1.6164   -3.4830   -3.5741 C.ar    1  <1>         0.2632
     17 C17         0.6789   -6.4424   -4.0211 C.2     1  <1>         0.2371
     18 C18         1.9274   -8.8602   -7.3213 C.3     1  <1>        -0.0378
     19 C19        -2.1874  -10.6131   -9.4777 C.3     1  <1>         0.0790
     20 C20        -3.9546   -7.4559   -5.1686 C.3     1  <1>         0.0790
     21 C21         1.9636   -5.9327   -3.3970 C.3     1  <1>         0.1040
     22 N1          1.4391   -3.5205   -0.6696 N.ar    1  <1>        -0.2298
     23 N2          1.7329   -4.6371   -2.7763 N.ar    1  <1>        -0.2898
     24 N3          0.9585   -7.2517   -5.1191 N.am    1  <1>        -0.2837
     25 O1          1.6923   -3.4619   -4.7990 O.2     1  <1>        -0.2669
     26 O2         -0.4256   -6.1563   -3.5700 O.2     1  <1>        -0.2735
     27 O3         -2.7176   -9.8330   -8.4079 O.3     1  <1>        -0.4914
     28 O4         -3.5906   -8.2727   -6.2796 O.3     1  <1>        -0.4914
     29 S1          2.3612    0.6778   -5.2360 S.2     1  <1>        -0.0966
     30 S2          1.0512   -0.8647   -0.6747 S.2     1  <1>        -0.0763
     31 H1          0.0574   -0.4648   -7.7724 H       1  <1>         0.0623
     32 H2         -0.4177   -1.6249   -5.4418 H       1  <1>         0.0629
     33 H3         -0.1187   -9.9489   -8.6838 H       1  <1>         0.0658
     34 H4         -1.6794   -7.1646   -4.8809 H       1  <1>         0.0674
     35 H5          2.0837    1.2088   -7.6047 H       1  <1>         0.0693
     36 H6          0.8746    1.0019   -2.2311 H       1  <1>         0.0700
     37 H7          1.7520   -5.5673   -0.8940 H       1  <1>         0.1030
     38 H8          2.2679   -8.0781   -8.0093 H       1  <1>         0.0278
     39 H9          2.5235   -8.8023   -6.4025 H       1  <1>         0.0278
     40 H10         2.1317   -9.8382   -7.7740 H       1  <1>         0.0278
     41 H11        -3.0074  -11.0637  -10.0422 H       1  <1>         0.0660
     42 H12        -1.5373  -11.3932   -9.0735 H       1  <1>         0.0660
     43 H13        -1.6073   -9.9638  -10.1376 H       1  <1>         0.0660
     44 H14        -5.0433   -7.4258   -5.0787 H       1  <1>         0.0660
     45 H15        -3.5623   -6.4462   -5.3135 H       1  <1>         0.0660
     46 H16        -3.5278   -7.8834   -4.2582 H       1  <1>         0.0660
     47 H17         2.7361   -5.8372   -4.1665 H       1  <1>         0.0589
     48 H18         2.3025   -6.6506   -2.6435 H       1  <1>         0.0589
     49 H19         1.9385   -7.3938   -5.3543 H       1  <1>         0.1549
@<TRIPOS>BOND
     1     1     2   ar
     2     1     5   ar
     3     2    13   ar
     4     3     9   ar
     5     3    11   ar
     6     4    10   ar
     7     4    12   ar
     8     5    29   ar
     9     6     7   ar
    10     6    30   ar
    11     7     8   ar
    12     7    13    1
    13     8    14   ar
    14     8    16   ar
    15     9    10   ar
    16     9    18    1
    17    10    24    1
    18    11    12   ar
    19    11    27    1
    20    12    28    1
    21    13    29   ar
    22    14    22   ar
    23    14    30   ar
    24    15    22   ar
    25    15    23   ar
    26    16    23   ar
    27    16    25    2
    28    17    21    1
    29    17    24   am
    30    17    26    2
    31    19    27    1
    32    20    28    1
    33    21    23    1
    34     1    31    1
    35     2    32    1
    36     3    33    1
    37     4    34    1
    38     5    35    1
    39     6    36    1
    40    15    37    1
    41    18    38    1
    42    18    39    1
    43    18    40    1
    44    19    41    1
    45    19    42    1
    46    19    43    1
    47    20    44    1
    48    20    45    1
    49    20    46    1
    50    21    47    1
    51    21    48    1
    52    24    49    1