ATOM 12
1 C1y C 18.0073 -15.4522
2 C1y C 18.0073 -16.8586
3 O2x O 19.2269 -14.7520
4 C1b C 16.7995 -14.7520
5 C1y C 19.2269 -17.5588
6 O1a O 16.7995 -17.5588
7 C1y C 20.4405 -15.4522
8 O1a O 15.5916 -15.4465
9 C1y C 20.4405 -16.8586
10 O1a O 19.2326 -18.9533
11 O1a O 21.6482 -14.7520
12 O1a O 21.6482 -17.5588
BOND 12
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 1 #Up
10 7 11 1 #Either
11 9 12 1 #Down
12 7 9 1
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