ATOM 12
1 C8y C 28.1400 -19.6969
2 C8x C 26.9278 -20.3938
3 C8x C 28.1400 -18.2915
4 C2b C 29.3522 -20.3938
5 C8x C 25.7157 -19.6969
6 C8x C 26.9278 -17.5947
7 C2b C 30.5643 -19.6911
8 C8y C 25.7157 -18.2915
9 C6a C 30.5643 -18.2915
10 O1a O 24.5035 -17.5947
11 O6a O 29.3522 -17.5947
12 O6a O 31.7765 -17.5888
BOND 12
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 2
6 4 7 2
7 5 8 2
8 7 9 1
9 8 10 1
10 9 11 1
11 9 12 2
12 6 8 1
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