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77.51607513427734,
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31.448867797851562,
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[H:23][c:9]1[c:8]([c:11]2[c:12]([c:10]([c:13]1[N:14]([H:25])[C:7](=[O:1])[N:15]([H:26])[C:19]([H:33])([H:34])[C:21]([H:37])([H:38])[C:20]([H:35])([H:36])[C:16]([H:27])([H:28])[N:4]=[C:3]=[S:2])[H:24])[O:6][C:18]([C:17]([O:5]2)([H:29])[H:30])([H:31])[H:32])[H:22] | [
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14.6222734... |
[H:35][c:14]1[c:17]([c:23]([c:18]([c:15]([c:21]1[C:7](=[O:1])[N:24]([H:40])[N:27]([H:41])[C:11](=[C:22]2[C:16](=[C:12]([C:19](=[O:3])[C:13](=[C:20]2[O:6][H:30])[H:34])[H:33])[H:37])[H:32])[H:36])[H:39])[C:29]([H:45])([H:46])[N:25]3[C:10](=[C:9]([C:8](=[N:5]3)[N+:26](=[O:2])[O-:4])[H:31])[C:28]([H:42])([H:43])[H:44])[H:... | [
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] | [
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[H:23][c:9]1[c:8]([c:11]2[c:12]([c:10]([c:13]1[N:14]([H:25])[C:7](=[O:1])[N:15]([H:26])[C:19]([H:33])([H:34])[C:21]([H:37])([H:38])[C:20]([H:35])([H:36])[C:16]([H:27])([H:28])[N:4]=[C:3]=[S:2])[H:24])[O:6][C:18]([C:17]([O:5]2)([H:29])[H:30])([H:31])[H:32])[H:22] | [
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-835748.3125
] | [
24.821447372436523,
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8.50181770324707,
1.3559259176254272,
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