ATOM 15
1 C8x C 14.4200 -17.9900
2 C8x C 14.4200 -19.3900
3 C8x C 15.6324 -20.0900
4 C8y C 16.8449 -19.3900
5 C8y C 16.8449 -17.9900
6 C8x C 15.6324 -17.2900
7 C2y C 18.1764 -19.8226
8 N2x N 18.9993 -18.6900
9 S2x S 18.1764 -17.5574
10 O3c O 17.4764 -16.3450
11 O3c O 19.3888 -16.8574
12 O2a O 18.6076 -21.1494
13 C1b C 19.9869 -21.4425
14 C2b C 20.4164 -22.7627
15 C2a C 21.8058 -23.0577
BOND 16
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 2
9 8 9 1
10 5 9 1
11 9 10 2
12 9 11 2
13 7 12 1
14 12 13 1
15 13 14 1
16 14 15 2
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