ATOM 20
1 C8x C 31.2943 -19.1126
2 C8x C 31.2943 -20.5128
3 C8x C 30.1041 -21.2829
4 C8y C 28.8439 -20.5128
5 C8y C 28.8439 -19.1126
6 C8x C 30.1041 -18.4125
7 C8x C 27.6538 -21.2829
8 C8x C 26.4636 -20.5128
9 C8y C 26.4636 -19.1126
10 C8y C 27.6538 -18.4125
11 N1a N 25.2734 -18.4125
12 N2b N 27.6538 -17.0123
13 N2b N 26.4636 -16.3122
14 C8y C 26.4636 -14.9120
15 C8x C 25.2734 -14.2119
16 C8x C 25.2734 -12.8117
17 C8x C 26.4636 -12.1117
18 C8x C 27.6538 -12.8117
19 C8y C 27.6538 -14.2119
20 C1a C 28.8692 -14.9071
BOND 22
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 4 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 5 10 1
12 9 11 1
13 10 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 14 19 1
22 19 20 1
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