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] | [
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2.08382... |
[H:41][c:21]1[c:20]([c:23]([c:22]([c:25]([c:24]1[S:9][C:15]2=[C:17]([N:27]([C:18]3=[C:14]2[N:6]=[C:13]([N:26]([C:10]3=[O:1])[H:43])[H:36])[H:44])[H:38])/[C:16](=[C:19](\[H:39])/[P:33](=[O:4])([O:7][H:34])[O:8][H:35])/[H:37])[H:42])[Br:5])[H:40].[H:47][C:30]([H:48])([H:49])[C:11](=[O:2])[N:29]([H:46])[C:32]([H:53])([H:5... | [
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2.414... |
[H:41][c:21]1[c:20]([c:23]([c:22]([c:25]([c:24]1[S:9][C:15]2=[C:17]([N:27]([C:18]3=[C:14]2[N:6]=[C:13]([N:26]([C:10]3=[O:1])[H:43])[H:36])[H:44])[H:38])/[C:16](=[C:19](\[H:39])/[P:33](=[O:4])([O:7][H:34])[O:8][H:35])/[H:37])[H:42])[Br:5])[H:40].[H:47][C:30]([H:48])([H:49])[C:11](=[O:2])[N:29]([H:46])[C:32]([H:53])([H:5... | [
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-0.19053... | [
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[H:41][c:21]1[c:20]([c:23]([c:22]([c:25]([c:24]1[S:9][C:15]2=[C:17]([N:27]([C:18]3=[C:14]2[N:6]=[C:13]([N:26]([C:10]3=[O:1])[H:43])[H:36])[H:44])[H:38])/[C:16](=[C:19](\[H:39])/[P:33](=[O:4])([O:7][H:34])[O:8][H:35])/[H:37])[H:42])[Br:5])[H:40].[H:47][C:30]([H:48])([H:49])[C:11](=[O:2])[N:29]([H:46])[C:32]([H:53])([H:5... | [
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] | [
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[H:37][c:16]1[c:13]([c:21]([c:15]([c:20]([c:23]1[N:25]([H:40])[C:30]([H:45])([H:46])[C:10]2=[N:6][N:26]3[C:12](=[C:11]2[H:33])[C:9](=[O:1])[N:27]([C:32]([C:31]3([H:47])[H:48])([H:49])[H:50])[c:24]4[c:18]([c:22]([c:14]([c:19]([c:17]4[H:38])[F:2])[H:35])[O:7][C:28]([H:41])([H:42])[H:43])[H:39])[F:3])[H:36])[O:8][C:29]([H... | [
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-1.1472690... | [
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] | [
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-8.0861377716... |
[H:42][c:17]1[c:16]([c:20]([c:21]([c:22]([c:23]1[C:10](=[O:2])[C:27]([H:48])([H:49])[O:8][c:19]2[c:14]([c:12]([c:18]([c:13]([c:15]2[H:40])[H:38])[F:4])[H:37])[H:39])[O:7][H:36])[O:6][H:35])[O:5][H:34])[H:41].[H:62][C@@:33]([C:11](=[O:3])[N:24]([H:43])[C:28]([H:50])([H:51])[H:52])([C:32]([H:60])([H:61])[C:31]([H:59])([C... | [
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-1.8767770528793335,
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2... | [
-1022785.4375
] | [
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-5.13717460... |
[H:41][c:21]1[c:20]([c:23]([c:22]([c:25]([c:24]1[S:9][C:15]2=[C:17]([N:27]([C:18]3=[C:14]2[N:6]=[C:13]([N:26]([C:10]3=[O:1])[H:43])[H:36])[H:44])[H:38])/[C:16](=[C:19](\[H:39])/[P:33](=[O:4])([O:7][H:34])[O:8][H:35])/[H:37])[H:42])[Br:5])[H:40].[H:47][C:30]([H:48])([H:49])[C:11](=[O:2])[N:29]([H:46])[C:32]([H:53])([H:5... | [
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5.05105... | [
-2996692.75
] | [
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2.5850377082824707,
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