ATOM 18
1 C8y C 26.5848 -18.3587
2 C8x C 26.5919 -19.7595
3 C8x C 25.3812 -20.4697
4 C8x C 24.1635 -19.7717
5 C8x C 24.1564 -18.3709
6 C8x C 25.3672 -17.6678
7 C1x C 32.6391 -16.2959
8 C1x C 32.6391 -17.6969
9 S2x S 31.4221 -18.3939
10 C2y C 30.2120 -17.6969
11 C2y C 30.2120 -16.2959
12 O2x O 31.4221 -15.5920
13 C1a C 28.9974 -15.5929
14 C5a C 28.9996 -18.3798
15 N1b N 27.8027 -17.6758
16 O5a O 28.9881 -19.7807
17 O3c O 30.7383 -19.6048
18 O3c O 32.4279 -19.4565
BOND 19
1 5 6 2
2 7 8 1
3 8 9 1
4 9 10 1
5 10 11 2
6 11 12 1
7 12 7 1
8 6 1 1
9 11 13 1
10 10 14 1
11 1 2 2
12 14 15 1
13 15 1 1
14 2 3 1
15 14 16 2
16 3 4 2
17 9 17 2
18 4 5 1
19 9 18 2
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