ATOM 15
1 C8y C 22.0500 -17.2200
2 C8y C 22.0500 -18.6200
3 C8y C 23.2624 -19.3200
4 N5x N 24.4749 -18.6200
5 C8y C 24.4749 -17.2200
6 N4x N 23.2624 -16.5200
7 O5x O 23.2624 -20.7198
8 C1a C 20.8376 -16.5200
9 N1b N 25.7060 -16.5090
10 C1b C 26.9112 -17.2047
11 C1a C 28.0935 -16.5219
12 C1b C 20.8376 -19.3200
13 C1b C 19.6251 -18.6200
14 C1b C 18.4127 -19.3200
15 C1a C 17.2003 -18.6200
BOND 15
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 3 7 2
8 1 8 1
9 5 9 1
10 9 10 1
11 10 11 1
12 2 12 1
13 12 13 1
14 13 14 1
15 14 15 1
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