ATOM 16
1 C8x C 21.9100 -18.0600
2 C8y C 21.9100 -19.4600
3 C8x C 23.1224 -20.1600
4 C8x C 24.3349 -19.4600
5 C8y C 24.3349 -18.0600
6 C8x C 23.1224 -17.3600
7 O2a O 25.5724 -17.3600
8 S4a S 26.7849 -18.0600
9 C1a C 27.9973 -17.3600
10 S2a S 20.6976 -20.1600
11 C5a C 19.4851 -19.4600
12 N1b N 18.2727 -20.1600
13 C1a C 17.0603 -19.4600
14 O5a O 19.4851 -18.0602
15 O3c O 26.0849 -19.3424
16 O3c O 27.7748 -19.2599
BOND 16
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 5 7 1
8 7 8 1
9 8 9 1
10 2 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 11 14 2
15 8 15 2
16 8 16 2
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