ATOM 13
1 C1a C 14.9800 -17.7800
2 C1b C 16.1700 -17.0800
3 C1b C 17.4300 -17.7800
4 C1b C 18.6200 -17.0800
5 C1b C 19.8100 -17.7800
6 C1b C 21.0700 -17.0800
7 C1b C 22.2600 -17.7800
8 C5a C 23.4500 -17.0800
9 C1b C 24.7100 -17.7800
10 C6a C 25.9000 -17.0800
11 O6a O 27.0900 -17.7800
12 O6a O 25.9000 -15.6800
13 O5a O 23.4500 -15.6800
BOND 12
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 10 12 2
12 8 13 2
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