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[H:18][c:17]1[c:16]([c:15]([c:14]([c:13]([c:12]1[C@:11]2([C:4](=[C:5]([N:6]([C:7](=[O:8])[N:9]2[H:10])[H:38])[C:39]([H:40])([H:41])[H:42])[C:2](=[O:3])[C:1]([H:43])([H:44])[H:45])[H:37])[H:36])[H:35])[O:20][C:21]3([C:28]([C:26]([C:25]([C:23]3([H:24])[H:34])([H:32])[H:33])([H:27])[H:31])([H:29])[H:30])[H:22])[H:19] | [
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[H+:38].[H:41][c:7]1[c:6]([c:5]([c:4]([c:9]([c:8]1[H:40])/[C:10](=[N+:11](\[H:37])/[C:12](=[O:13])[C:14]2=[C:15]([C:16](=[C:17]([N:18]2[H:19])[H:20])[C:21](=[O:22])[C:23]([H:34])([H:35])[C-:24]([H:33])[C:29]([H:30])([H:31])[H:32])[H:36])/[H:39])[O:3][C:1]([H:2])([H:44])[H:45])[H:43])[H:42].[H:26][C-:25]([H:27])[H:28] | [
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[H+:23].[H:41][c:37]1[c:36]([c:35]([c:34]2[c:39]([c:38]1[H:40])[N:30]([C:31](=[O:32])[O:33]2)[C:29]([H:44])([H:45])[C:26]([H:27])([H:28])[C:2](=[O:1])[N:3]([H:4])[C:5]([H:6])([H:25])[C-:7]([H:24])[C:8]3=[C:9]([C:10]([C:11]([C:12]([C:13]3([H:14])[H:15])([H:16])[H:17])([H:18])[H:19])([H:20])[H:21])[H:22])[H:43])[H:42] | [
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[H:36][c:24]1[c:25]([c:26]2[c:27]([c:28]([c:23]1[C:22]([H:37])([H:38])[N:18]3[C:19]([C:13]4=[C:14]([C:41]([C:5]([C:10]([C:11]4=[O:12])([H:44])[H:45])([C:1]([H:2])([H:3])[H:4])[C:6]([H:7])([H:8])[H:9])([H:42])[H:43])[N:15]([C:17]3([H:39])[H:40])[H:16])([H:20])[H:21])[H:29])[O:30][C:31]([O:32]2)([H:33])[H:34])[H:35] | [
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[H:27][c:23]1[c:22]([c:21]([c:20]2[c:25]([c:24]1[H:26])[C:17](=[C:18]([N:19]2[H:30])[H:31])[C:16]([H:32])([H:33])[C:14](=[O:15])[O:13][C:11]([H:12])([H:34])[C:9](=[O:10])[N:8]3[C:35]([C:37]([C:5]([C:6]([C:7]3([H:41])[H:42])([H:43])[H:44])([H:45])[C:1]([H:2])([H:3])[H:4])([H:38])[H:39])([H:36])[H:40])[H:29])[H:28] | [
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[H:11][c:10]1[c:9]([c:8]([c:7]([c:6]([c:5]1[C:3](=[O:4])[C:2]([H:41])([H:42])[C:1]([H:43])([H:44])[H:45])[H:40])[H:39])[O:13][C:14]([H:37])([H:38])[C:15](=[O:16])[N:17]([H:18])[C:19]2([C:26]([C:25]([C:24]([C:23]([C:22]2([H:35])[H:36])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([H:27])[H:28])[C:20]#[N:21])[H:12] | [
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[H:37][c:28]1[c:29]([c:30]([c:25]([c:26]([c:27]1[C:38]([H:39])([H:40])[H:41])[H:42])[N:24]([H:43])[C:22](=[O:23])[C:7]2=[C:6]([C:10](=[C:9]([N:8]2[H:21])[C:17]([H:18])([H:19])[H:20])[C:11](=[O:12])[C:13]([H:14])([H:15])[H:16])[C:5]([H:44])([H:45])[C:1]([H:2])([H:3])[H:4])[O:31][C:32]([H:33])([H:34])[H:35])[H:36] | [
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[H:28][c:23]1[c:24]([c:25]([c:20]([c:21]([c:22]1[H:29])[H:30])[C:15]2=[N:14][C:13](=[C:12]([C:17](=[O:18])[N:16]2[H:19])[C:11]([H:35])([H:36])[C:9](=[O:10])[O:8][C:5]([H:6])([H:7])[C:4]([H:37])([H:38])[C:3]([H:39])([H:40])[C:2]([H:41])([H:42])[C:1]([H:43])([H:44])[H:45])[C:31]([H:32])([H:33])[H:34])[H:26])[H:27] | [
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[H:28][c:23]1[c:24]([c:25]([c:20]([c:21]([c:22]1[H:29])[H:30])[C:15]2=[N:14][C:13](=[C:12]([C:17](=[O:18])[N:16]2[H:19])[C:11]([H:35])([H:36])[C:9](=[O:10])[O:8][C:5]([H:6])([H:7])[C:4]([H:37])([H:38])[C:3]([H:39])([H:40])[C:2]([H:41])([H:42])[C:1]([H:43])([H:44])[H:45])[C:31]([H:32])([H:33])[H:34])[H:26])[H:27] | [
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[H:42][c:6]1[c:7]([c:8]2[c:9]([c:4]([c:5]1[H:43])[O:3][C:1]([H:2])([H:44])[H:45])[C:10](=[C:11]([N:12]([C:13]2=[O:14])[C:15]([H:16])([H:38])[C:17](=[O:18])[N:19]3[C:26]([C:25]([C:24]([C:23]([C:21]([C:20]3([H:36])[H:37])([H:22])[H:35])([H:33])[H:34])([H:31])[H:32])([H:29])[H:30])([H:27])[H:28])[H:39])[H:40])[H:41] | [
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-649076.5
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... |
[H:19][c:13]1[c:12]([c:11]([c:10]2[c:15]([c:14]1[H:18])[C:16](=[O:17])[N:7]([C:8]2=[O:9])[C:6]([H:22])([H:23])[C:5]([H:24])([H:25])[C:3](=[O:4])[N:2]([C:26]3([C:31]([C:30]([C:29]([C:28]([C:27]3([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])[H:42])[C:1]([H:43])([H:44])[H:45])[H:21])[H:20] | [
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-2.6774399280548096... | [
-649104.5
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0.275556... |
[H+:27].[H:28][C:23]1=[C-:24][C:25](=[C:20]([C:21](=[C:22]1[H:29])[H:30])/[C:15](=[N:14]/[C:13](=[C-:12]/[C:11]([H:35])([H:36])[C:9](=[O:10])[O:8][C:5]([H:6])([H:7])[C:4]([H:37])([H:38])[C:3]([H:39])([H:40])[C:2]([H:41])([H:42])[C:1]([H:43])([H:44])[H:45])/[C:31]([H:32])([H:33])[H:34])/[N:16]([H:19])[C:17]#[O+:18])[H:2... | [
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... | [
-648746
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[H:33][c:28]1[c:29]([c:30]([c:25]([c:26]([c:27]1[H:34])[H:35])[C:24]([H:36])([H:37])[C:23]([H:38])([H:39])[N:21]([H:22])[C:20]([H:40])([H:41])[c:7]2[c:6]([c:5]([c:4]([c:9]([c:8]2[H:19])[O:10][C:11]([H:17])([H:18])[C:12](=[O:13])[N:14]([H:15])[H:16])[O:3][C:1]([H:2])([H:44])[H:45])[H:43])[H:42])[H:31])[H:32] | [
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... | [
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29.0705451... |
[H:33][c:28]1[c:29]([c:30]([c:25]([c:26]([c:27]1[H:34])[H:35])[C:24]([H:36])([H:37])[C:23]([H:38])([H:39])[N:21]([H:22])[C:20]([H:40])([H:41])[c:7]2[c:6]([c:5]([c:4]([c:9]([c:8]2[H:19])[O:10][C:11]([H:17])([H:18])[C:12](=[O:13])[N:14]([H:15])[H:16])[O:3][C:1]([H:2])([H:44])[H:45])[H:43])[H:42])[H:31])[H:32] | [
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-1.07092... | [
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[H:40][c:16]1[c:17]([c:18]([c:19]([c:14]([c:15]1[H:41])[O:13][C:11]([H:12])([H:42])[C:10]([H:43])([H:44])[C:5]([H:45])([C:1]([H:2])([H:3])[H:4])[C:6]([H:7])([H:8])[H:9])[H:20])[O:21][C:22]([H:37])([H:38])[C:23](=[O:24])[N:25]([H:36])[c:26]2[c:31]([c:30]([n:29][c:28]([c:27]2[H:35])[H:34])[H:33])[H:32])[H:39] | [
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[H:28][c:23]1[c:24]([c:25]([c:20]([c:21]([c:22]1[H:29])[H:30])[C:15]2=[N:14][C:13](=[C:12]([C:17](=[O:18])[N:16]2[H:19])[C:11]([H:35])([H:36])[C:9](=[O:10])[O:8][C:5]([H:6])([H:7])[C:4]([H:37])([H:38])[C:3]([H:39])([H:40])[C:2]([H:41])([H:42])[C:1]([H:43])([H:44])[H:45])[C:31]([H:32])([H:33])[H:34])[H:26])[H:27] | [
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-649092.5
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[H:24][c:23]1[c:22]([c:21]([c:20]([c:19]([c:18]1[C:17](=[C:16]([H:33])[C:14]2=[N:15][N:9]([C:10](=[O:11])[C:12]([C:13]2([H:34])[H:35])([H:36])[H:37])[C@:8]([H:42])([C:6](=[O:7])[O:5][C:2]([H:3])([H:4])[C:1]([H:43])([H:44])[H:45])[C:38]([H:39])([H:40])[H:41])[H:32])[H:31])[H:30])[C:26]([H:27])([H:28])[H:29])[H:25] | [
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[H:23][c:17]1[c:18]([c:19]([c:20]2[c:15]([c:16]1[H:24])[C:14](=[C:13]([N:12]2[C:11]([H:36])([H:37])[C:9](=[O:10])[N:8]([H:38])[C:7]([H:39])([H:40])[C:5]([H:6])([H:41])[C:4]([H:42])([H:43])[O:3][C:1]([H:2])([H:44])[H:45])[H:35])[C:25](=[O:26])[C:27]3([C:29]([C:28]3([H:32])[H:33])([H:30])[H:31])[H:34])[H:21])[H:22] | [
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[H:40][c:7]1[c:6]([c:5]([c:4]2[c:9]([c:8]1[H:39])[c:10]([c:11]([c:2]([n:3]2)[C:1]([H:43])([H:44])[H:45])[H:12])[C:13](=[O:14])[O:15][C:16]([H:17])([H:18])[C:19](=[O:20])[N:21]([H:22])[C:23]([H:24])([H:25])[C:26]([H:27])([H:28])[C:29]([H:38])([C:30]([H:31])([H:32])[H:33])[C:34]([H:35])([H:36])[H:37])[H:42])[H:41] | [
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[H:34][c:29]1[c:30]([c:31]([c:26]([c:27]([c:28]1[H:35])[H:36])[C:25]([H:37])([H:38])[N:20]([C:18](=[O:19])[C:10]2=[C:11]([N:12]([C:8](=[C:9]2[C:39]([H:40])([H:41])[H:42])[C:6](=[O:7])[O:5][C:2]([H:3])([H:4])[C:1]([H:43])([H:44])[H:45])[H:13])[C:14]([H:15])([H:16])[H:17])[C:21]([H:22])([H:23])[H:24])[H:32])[H:33] | [
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... | [
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] | [
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[H:27][c:21]1[c:22]([c:23]2[c:18]([c:19]([c:20]1[C:28]([H:29])([H:30])[H:31])[H:32])[C:17](=[C:16]([N:24]2[H:25])[C:14](=[O:15])[N:13]3[C:12]([C:9]([C:8]([C:35]([C:34]3([H:38])[H:39])([H:36])[H:37])([H:42])[C:6](=[O:7])[O:5][C:2]([H:3])([H:4])[C:1]([H:43])([H:44])[H:45])([H:10])[H:11])([H:40])[H:41])[H:33])[H:26] | [
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0.5818910... | [
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] | [
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[H:33][c:28]1[c:29]([c:30]([c:25]([c:26]([c:27]1[H:34])[H:35])[C:24]([H:36])([H:37])[C:23]([H:38])([H:39])[N:21]([H:22])[C:20]([H:40])([H:41])[c:7]2[c:6]([c:5]([c:4]([c:9]([c:8]2[H:19])[O:10][C:11]([H:17])([H:18])[C:12](=[O:13])[N:14]([H:15])[H:16])[O:3][C:1]([H:2])([H:44])[H:45])[H:43])[H:42])[H:31])[H:32] | [
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-1... | [
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] | [
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1.16... |
[H:18][c:17]1[c:16]([c:15]([c:14]([c:13]([c:12]1[C@:11]2([C:4](=[C:5]([N:6]([C:7](=[O:8])[N:9]2[H:10])[H:38])[C:39]([H:40])([H:41])[H:42])[C:2](=[O:3])[C:1]([H:43])([H:44])[H:45])[H:37])[H:36])[H:35])[O:20][C:21]3([C:28]([C:26]([C:25]([C:23]3([H:24])[H:34])([H:32])[H:33])([H:27])[H:31])([H:29])[H:30])[H:22])[H:19] | [
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... | [
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] | [
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100.54450988769531,
181.... |
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