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2.0899009704589844
],
[
2.090242862701416
],
[
2.0853471755981445
],
[
2.0974721908569336
],
[
2.0899009704589844
],
[
2.1030189990997314
],
[
2.098599433898926
],
[
2.0853471755981445
],
[
2.097771167755127
],
[
2.098599433898926
],
... | Brc1cccc(OCCCn2ccnc2)c1 |
[
[
0,
1,
1,
2,
2,
3,
3,
4,
4,
5,
5,
6,
6,
7,
6,
8,
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9,
9,
10,
10,
11,
11,
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13,
13,
14,
13,
15,
15,
16,
16,
17,
16,
18,
16,
19,
15,
20,
20,
2... | [
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[
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0,
0
],
[
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[
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[
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[
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[
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[
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0,
0
],
[
0,
0,
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[
0,
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1
],... | [
[
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0,
3,
5,
2,
0,
1,
0,
0
],
[
5,
0,
3,
5,
1,
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0,
0
],
[
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4,
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1,
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2,
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1
],
[
5,
0,
4,
5,
2,
0,
2,
0,
1
],
[
5,
0,
4,
5,
... | [
[
0,
2,
2,
3,
4,
101,
101,
101,
5,
5,
6,
6,
6,
100,
100,
7,
8,
82,
82,
9,
9,
9,
10,
10,
11,
14,
14,
13,
13,
15,
15,
16,
103,
103,
17,
17,
18,
18,
19,
20,
... | [
[
2.1855616569519043
],
[
2.0781843662261963
],
[
2.0945425033569336
],
[
2.1855616569519043
],
[
1.0634136199951172
],
[
1.0282857418060303
],
[
2.0738325119018555
],
[
2.0391547679901123
],
[
2.0781843662261963
],
[
1.0499162673950195
]... | [
[
0,
1,
1,
2,
2,
3,
3,
4,
6,
7,
8,
9,
9,
10,
10,
11,
11,
12,
12,
13,
13,
14,
13,
15,
16,
17,
16,
18,
16,
19,
15,
20,
20,
21,
21,
22,
21,
23,
23,
24,
24,... | [
[
1,
0,
0
],
[
1,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
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0
],
[
0,
0,
0
],
[
0,
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0
],
[
0,
0,
0
],
[
1,
0,
1
],
[
1,
0,
1
],
[
0,
0,
0
],... | [
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0,
0,
0,
0,
1,
2,
2,
3,
3,
3,
3,
3,
3,
3,
3,
4,
4,
4,
4,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
3,
5,
5,
6,
7,
7,
7,
7,
7,
7
] | [
[
0,
2,
2,
3,
4,
87,
5,
5,
6,
86,
86,
7,
10,
89,
89,
11,
12,
12,
13,
14,
95,
15,
15,
16,
16,
88,
17,
18,
18,
19,
19,
22,
21,
21,
23,
23,
30,
25,
25,
27,
... | [
[
2.1855616569519043
],
[
2.0781843662261963
],
[
2.0945425033569336
],
[
2.1855616569519043
],
[
1.0634136199951172
],
[
1.0282857418060303
],
[
2.0781843662261963
],
[
1.0499162673950195
],
[
1.0282857418060303
],
[
2.0945425033569336
]... | C=CC1CC1(NC(=O)C1CC2CN1C(=O)C(C(C)(C)C)NC(=O)OCCCC=Cc1cccc3c1CN(CC3)C(=O)O2)C(=O)NS(=O)(=O)C1CC1 |
[
[
0,
1,
1,
2,
2,
3,
3,
4,
4,
5,
5,
6,
6,
7,
7,
8,
8,
9,
3,
10,
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11,
11,
12,
12,
13,
13,
14,
14,
15,
15,
16,
16,
17,
11,
1,
17,
12,
9,
4
],
[
1,
... | [
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
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],
[
0,
0,
0
],
[
0,
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0
],
[
0,
0,
0
],
[
3,
0,
1
],
[
3,
0,
1
],
[
3,
0,
1
],... | [
[
5,
0,
4,
5,
3,
0,
2,
0,
0
],
[
5,
0,
4,
5,
1,
0,
2,
0,
1
],
[
6,
0,
3,
5,
1,
0,
2,
0,
1
],
[
4,
0,
3,
5,
0,
0,
1,
0,
1
],
[
5,
0,
3,
5,
... | [
[
0,
0,
2,
35,
35,
3,
3,
4,
4,
5,
6,
6,
18,
7,
7,
8,
39,
9,
9,
10,
11,
12,
13,
14,
15,
16,
38,
38,
17,
19,
19,
20,
20,
34,
34,
21,
22,
22,
23,
23,
24,
... | [
[
1.9180649518966675
],
[
1.9093267917633057
],
[
1.8048255443572998
],
[
1.894357442855835
],
[
2.013324737548828
],
[
1.9180649518966675
],
[
1.8436849117279053
],
[
2.174243211746216
],
[
1.8360793590545654
],
[
1.8048255443572998
],
... | [
[
0,
1,
1,
2,
2,
3,
3,
4,
4,
5,
5,
6,
6,
7,
7,
8,
8,
9,
3,
10,
10,
11,
12,
13,
13,
14,
14,
15,
15,
16,
16,
17,
11,
1,
17,
12,
9,
4
],
[
1,
0,
2,
... | [
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
3,
0,
1
],
[
3,
0,
1
],
[
3,
0,
1
],... | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
1,
1,
1,
1,
1,
1
] | [
[
0,
0,
2,
33,
3,
3,
4,
4,
5,
6,
6,
18,
7,
7,
8,
37,
9,
9,
10,
11,
12,
13,
14,
15,
16,
36,
36,
17,
19,
19,
20,
32,
32,
21,
22,
35,
23,
24,
25,
26,
27,
... | [
[
1.9180649518966675
],
[
1.9093267917633057
],
[
1.8048255443572998
],
[
1.894357442855835
],
[
1.9180649518966675
],
[
1.8436849117279053
],
[
2.174243211746216
],
[
1.8360793590545654
],
[
1.8048255443572998
],
[
2.1689114570617676
],
... | CC1NB(c2ccccc2)OC1c1ccccc1 |
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