ATOM 12
1 C1c C 27.6828 -15.3288
2 N1b N 27.6828 -16.7277
3 C6a C 28.8943 -14.6323
4 C1b C 26.4651 -14.6323
5 O6a O 30.1060 -15.3288
6 O6a O 28.8943 -13.2274
7 C1b C 25.2534 -15.3288
8 S2a S 24.0417 -14.6323
9 C1a C 22.8300 -15.3288
10 C5a C 28.8624 -17.4300
11 C1a C 30.0749 -16.7300
12 O5a O 28.8531 -18.8299
BOND 11
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 3 5 1
5 3 6 2
6 4 7 1
7 7 8 1
8 8 9 1
9 2 10 1
10 10 11 1
11 10 12 2
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