ATOM 13
1 C2a C 6.7200 -12.2500
2 C2c C 7.9324 -11.5500
3 C7a C 9.1449 -12.2500
4 O7a O 10.3573 -11.5500
5 C1c C 11.5697 -12.2500
6 C1d C 12.7822 -11.5500
7 C3b C 7.9324 -10.1502
8 O6a O 9.1449 -13.6498
9 C1a C 11.5697 -13.6499
10 X F 13.9946 -10.8500
11 X F 12.0696 -10.3618
12 X F 13.5095 -12.7627
13 N3a N 7.9324 -8.7502
BOND 12
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 7 1
7 3 8 2
8 5 9 1
9 6 10 1
10 6 11 1
11 6 12 1
12 7 13 3
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