ATOM 12
1 C8x C 25.4833 -20.2139
2 C8x C 25.4833 -21.6140
3 C8x C 26.6997 -22.3106
4 C8x C 27.9092 -21.6140
5 N5x N 27.9092 -20.2139
6 C8y C 26.6997 -19.5102
7 O2a O 26.6864 -18.1099
8 C1b C 27.8967 -17.4063
9 S4a S 29.1070 -18.1029
10 O1d O 30.5072 -18.1029
11 O1d O 29.1070 -16.7026
12 O1d O 29.1070 -19.5033
BOND 12
1 6 1 1
2 6 7 1
3 1 2 2
4 7 8 1
5 2 3 1
6 8 9 1
7 3 4 2
8 9 10 1
9 4 5 1
10 9 11 2
11 5 6 2
12 9 12 2
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