ATOM 15
1 C8y C 27.0200 -15.8200
2 C8x C 25.7600 -15.1200
3 C8x C 27.0200 -17.2200
4 C1b C 28.2100 -15.1200
5 C8y C 24.5700 -15.8200
6 C8x C 25.7600 -17.9200
7 C1b C 29.4700 -15.8200
8 C8y C 24.5700 -17.2200
9 O2a O 23.3800 -15.1200
10 N1a N 30.6600 -15.1200
11 O1a O 23.3800 -17.9200
12 S4a S 21.9800 -15.1200
13 O1d O 21.9800 -13.7200
14 O1d O 21.9800 -16.5200
15 O1d O 20.5800 -15.1200
BOND 15
1 2 5 2
2 3 6 1
3 4 7 1
4 5 8 1
5 5 9 1
6 7 10 1
7 8 11 1
8 6 8 2
9 9 12 1
10 1 2 1
11 12 13 2
12 1 3 2
13 12 14 2
14 1 4 1
15 12 15 1
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