ATOM 12
1 C1b C 21.6503 -16.5328
2 C5a C 20.4593 -15.8322
3 C1c C 19.2683 -16.5328
4 C1c C 18.0774 -15.8322
5 C5a C 16.8164 -16.5328
6 C1b C 15.6254 -15.8322
7 O1a O 14.4344 -16.5328
8 O5a O 16.8164 -17.9339
9 O1a O 18.0073 -14.4311
10 O1a O 19.2683 -17.9339
11 O5a O 20.4593 -14.4311
12 O1a O 22.9113 -15.8322
BOND 11
1 1 2 1
2 6 7 1
3 3 4 1
4 5 8 2
5 4 9 1 #Up
6 4 5 1
7 3 10 1 #Up
8 2 3 1
9 2 11 2
10 5 6 1
11 1 12 1
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