ATOM 22
1 C8x C 6.3700 -17.3600
2 C8x C 6.3700 -18.7600
3 C8x C 7.5824 -19.4600
4 C8x C 8.7949 -18.7600
5 C8y C 8.7949 -17.3600
6 C8x C 7.5824 -16.6600
7 C8x C 11.2197 -18.7600
8 C8y C 11.2197 -17.3600
9 S4a S 10.0073 -16.6600
10 C8x C 12.4322 -19.4600
11 C8y C 13.6446 -18.7600
12 C8y C 13.6446 -17.3600
13 C8x C 12.4322 -16.6600
14 N4x N 14.9761 -19.1926
15 C8y C 15.7990 -18.0600
16 N5x N 14.9761 -16.9274
17 O3c O 10.0073 -15.2600
18 N1b N 17.2200 -18.0600
19 C7a C 17.9200 -16.8476
20 O7a O 19.3198 -16.8476
21 O6a O 17.2296 -15.6521
22 C1a C 20.0103 -15.6520
BOND 24
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 11 14 1
16 14 15 1
17 15 16 2
18 12 16 1
19 9 17 2
20 15 18 1
21 18 19 1
22 19 20 1
23 19 21 2
24 20 22 1
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