ATOM 12
1 C8y C 28.8817 -17.8847
2 C8x C 27.6782 -17.1904
3 C8x C 30.0734 -17.1904
4 S4a S 28.8817 -19.2675
5 C8x C 27.6782 -15.8078
6 C8x C 30.0734 -15.8078
7 O1d O 28.8874 -20.8526
8 O1d O 27.6841 -19.9618
9 O1d O 30.0793 -19.9559
10 C8y C 28.8817 -15.1135
11 C1b C 28.8817 -13.7309
12 O1a O 30.0793 -13.0423
BOND 12
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 4 7 1
7 4 8 2
8 4 9 2
9 5 10 1
10 10 11 1
11 11 12 1
12 6 10 2
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