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[H:35][c:19]1[c:17]([c:21]([c:18]([c:20]([c:22]1[N:23]2/[C:16](=[C:15](\[C:7]#[N:1])/[C:11](=[O:2])[O:8][C:26]([H:38])([H:39])[H:40])/[S:10][C:29]([C:13]2=[O:4])([H:47])[H:48])[F:6])[H:34])[O:9][C:27]([H:41])([H:42])[H:43])[H:33].[H:55][C@@:32]([C:14](=[O:5])[N:24]([H:36])[C:30]([H:49])([H:50])[H:51])([C:31]([H:52])([H... | [
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[H:34][c:16]1[c:15]([c:18]([c:19]([c:17]([c:20]1[N:22]([H:38])/[C:14](=[N:7]/[O:8][H:32])/[C:12]2=[N:5][O:9][N:6]=[C:13]2[N:21]([H:36])[H:37])[H:35])[Cl:4])[F:3])[H:33].[H:56][C@@:31]([C:11](=[O:2])[N:23]([H:39])[C:26]([H:44])([H:45])[H:46])([C:30]([H:54])([H:55])[C:29]([H:53])([C:27]([H:47])([H:48])[H:49])[C:28]([H:50... | [
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[H:28][c:10]1[c:12]([c:15]([c:13]([c:14]([c:11]1[H:29])[Br:5])[H:31])[C:21]([H:41])([H:42])[N:17]([H:33])[C:24]([H:47])([H:48])[C:22]([H:43])([H:44])[O:6][H:27])[H:30].[H:51][C@@:26]([C:9](=[O:3])[N:16]([H:32])[C:20]([H:38])([H:39])[H:40])([C:25]([H:49])([H:50])[C:23]([H:45])([H:46])[C:8](=[O:2])[O-:4])[N:18]([H:34])[C... | [
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-3.366... | [
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[H:58][C@@:30]([C:16](=[O:6])[N:17]([H:33])[C:22]([H:43])([H:44])[H:45])([C:29]([H:56])([H:57])[C:24]([H:48])([H:49])[C:13](=[O:7])[O-:3])[N:19]([H:36])[C:11](=[O:1])[C:21]([H:40])([H:41])[H:42].[H:55][C@:28]([C:15](=[O:5])[O:9][H:32])([C:27]([H:53])([H:54])[C@@:25]([H:50])([C:14](=[O:4])[O:8][H:31])[N:18]([H:34])[H:35... | [
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] | [
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[H:40][c:19]1[c:17]([c:15]([n:5][c:16]([c:18]1[H:39])[C:14]2=[C:13]([S:6][C:12](=[N:4]2)[N:26]([H:45])[C:9](=[O:1])[c:25]3[c:22]([c:20]([c:24]([c:21]([c:23]3[H:44])[H:42])[S:7][C:29]([H:48])([H:49])[H:50])[H:41])[H:43])[H:36])[H:37])[H:38].[H:64][C@@:35]([C:11](=[O:3])[N:27]([H:46])[C:32]([H:57])([H:58])[H:59])([C:34](... | [
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-1647884.75
] | [
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[H:45][C@@:21]([C:11](=[O:3])[N:12]([H:27])[C:16]([H:34])([H:35])[H:36])([C@@:22]([H:46])([C:19]([H:40])([H:41])[H:42])[O:7][H:25])[N:14]([H:30])[C:9](=[O:1])[C:15]([H:31])([H:32])[H:33].[H:37][C@@:17]([C:10](=[O:2])[O:6][H:24])([C:18]([H:38])([H:39])[C:20]([H:43])([H:44])[S:23](=[O:4])(=[O:5])[O:8][H:26])[N:13]([H:28]... | [
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5.55610... | [
-1002362.75
] | [
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[H:58][C@@:30]([C:16](=[O:6])[N:17]([H:33])[C:22]([H:43])([H:44])[H:45])([C:29]([H:56])([H:57])[C:24]([H:48])([H:49])[C:13](=[O:3])[O-:7])[N:19]([H:36])[C:11](=[O:1])[C:21]([H:40])([H:41])[H:42].[H:55][C@:28]([C:15](=[O:5])[O:9][H:32])([C:27]([H:53])([H:54])[C@@:25]([H:50])([C:14](=[O:4])[O:8][H:31])[N:18]([H:34])[H:35... | [
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-3.439... | [
-992377.0625
] | [
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[H:36][C:19]1=[C:22]([N:26]([C:12](=[O:3])[C:18](=[C:21]1[C:16]2=[N:8][N:24]([C:17](=[N:9]2)[C:23]3=[C:20]([C:11](=[O:2])[N:25]([C:14](=[O:5])[C:30]3([H:46])[H:47])[H:39])[H:37])[H:38])[H:35])[H:40])[C:7]#[N:1].[H:53][C@@:33]([C:15](=[O:6])[N:27]([H:41])[C:31]([H:48])([H:49])[H:50])([C:32]([H:51])([H:52])[O:10][H:34])[... | [
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-4.439... | [
-1020060.625
] | [
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12.353951... |
[H:30][c:12]1[c:10]([c:13]([c:11]([c:14]([c:15]1[C:20]([H:39])([H:40])[C:8](=[O:2])[O:5][H:27])[O:6][C:18]([H:33])([H:34])[H:35])[H:29])[Br:4])[H:28].[H:53][C@@:26]([C:9](=[O:3])[N:16]([H:31])[C:21]([H:41])([H:42])[H:43])([C:25]([H:51])([H:52])[C:24]([H:50])([C:22]([H:44])([H:45])[H:46])[C:23]([H:47])([H:48])[H:49])[N:... | [
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-0.5913220... | [
-2360594.25
] | [
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-16.2387... |
[H:30][c:12]1[c:10]([c:13]([c:11]([c:14]([c:15]1[C:20]([H:39])([H:40])[C:8](=[O:2])[O:5][H:27])[O:6][C:18]([H:33])([H:34])[H:35])[H:29])[Br:4])[H:28].[H:53][C@@:26]([C:9](=[O:3])[N:16]([H:31])[C:21]([H:41])([H:42])[H:43])([C:25]([H:51])([H:52])[C:24]([H:50])([C:22]([H:44])([H:45])[H:46])[C:23]([H:47])([H:48])[H:49])[N:... | [
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-3.11824... | [
-2360602.5
] | [
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[H:55][C@:27]1([C@@:25]([C@@:26]([C@@:28]2([C:22]([O:7][C@:23]1([O:10]2)[H:50])([H:48])[H:49])[C:21]([H:46])([H:47])[O:6][H:31])([H:54])[O:9][H:33])([H:53])[O:8][H:32])[N:16]([H:35])[C:11](=[O:1])[C:18]([H:37])([H:38])[H:39].[H:58][C@@:30]([C:14](=[O:4])[N:15]([H:34])[C:20]([H:43])([H:44])[H:45])([C:29]([H:56])([H:57])... | [
-3.2212629318237305,
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0.00... | [
-992347.6875
] | [
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1.0397943258... |
[H:36][C:19]1=[C:22]([N:26]([C:12](=[O:3])[C:18](=[C:21]1[C:16]2=[N:8][N:24]([C:17](=[N:9]2)[C:23]3=[C:20]([C:11](=[O:2])[N:25]([C:14](=[O:5])[C:30]3([H:46])[H:47])[H:39])[H:37])[H:38])[H:35])[H:40])[C:7]#[N:1].[H:53][C@@:33]([C:15](=[O:6])[N:27]([H:41])[C:31]([H:48])([H:49])[H:50])([C:32]([H:51])([H:52])[O:10][H:34])[... | [
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8.5947... | [
-1020075.625
] | [
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-13.5316... |
[H:30][c:12]1[c:10]([c:13]([c:11]([c:14]([c:15]1[C:20]([H:39])([H:40])[C:8](=[O:2])[O:5][H:27])[O:6][C:18]([H:33])([H:34])[H:35])[H:29])[Br:4])[H:28].[H:53][C@@:26]([C:9](=[O:3])[N:16]([H:31])[C:21]([H:41])([H:42])[H:43])([C@@:25]([H:52])([C:23]([H:47])([H:48])[H:49])[C:24]([H:50])([H:51])[C:22]([H:44])([H:45])[H:46])[... | [
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0.941398... | [
-2360603.75
] | [
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-1.4275044202804565,
-8.825568199157715,
1.8785243034362793,
-15.799346923828125,
5.00... |
[H:36][C:19]1=[C:22]([N:26]([C:12](=[O:3])[C:18](=[C:21]1[C:16]2=[N:8][N:24]([C:17](=[N:9]2)[C:23]3=[C:20]([C:11](=[O:2])[N:25]([C:14](=[O:5])[C:30]3([H:46])[H:47])[H:39])[H:37])[H:38])[H:35])[H:40])[C:7]#[N:1].[H:53][C@@:33]([C:15](=[O:6])[N:27]([H:41])[C:31]([H:48])([H:49])[H:50])([C:32]([H:51])([H:52])[O:10][H:34])[... | [
2.745513916015625,
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