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@@ -98,7 +98,7 @@ export class Mol2Encoder extends LigandEncoder {
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let result = iter.next();
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let result = iter.next();
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while (!result.done) {
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while (!result.done) {
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const [k, v] = result.value;
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const [k, v] = result.value;
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- if (NON_METAL_ATOMS.some(a => k.startsWith(a))) {
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+ if (this.isNonMetalBond(k)) {
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ret.set(k, v);
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ret.set(k, v);
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}
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}
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result = iter.next();
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result = iter.next();
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