ATOM 12
1 C1b C 18.0148 -15.8076
2 C1c C 16.7988 -16.5127
3 C1b C 19.2308 -16.5127
4 C1b C 15.5764 -15.8076
5 S1a S 16.7988 -17.9226
6 C1b C 20.4532 -15.8076
7 C1b C 14.3604 -16.5127
8 C1b C 21.6692 -16.5127
9 S1a S 13.1446 -15.8076
10 C6a C 22.8916 -15.8076
11 O6a O 24.1076 -16.5191
12 O6a O 22.9175 -14.4881
BOND 11
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1 #Up
5 3 6 1
6 4 7 1
7 6 8 1
8 7 9 1
9 8 10 1
10 10 11 1
11 10 12 2
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