ATOM 22
1 C8y C 20.5751 -15.5520
2 C8y C 19.3645 -14.8503
3 C8y C 20.5634 -16.9499
4 C8x C 21.7797 -14.8562
5 C8y C 18.1480 -15.5403
6 C8x C 19.3703 -13.4467
7 C8y C 21.7680 -17.6633
8 C8x C 22.9903 -15.5637
9 C8y C 16.9434 -14.8386
10 O5x O 18.1422 -16.9439
11 O2x O 18.1597 -12.7450
12 C8y C 23.0545 -16.9616
13 O2x O 22.0604 -19.0376
14 C8y C 16.9491 -13.4409
15 C8x C 15.7386 -15.5345
16 O2x O 24.0255 -17.9029
17 C1x C 23.4582 -19.1837
18 C8x C 15.7386 -12.7392
19 C8x C 14.5281 -14.8386
20 C8y C 14.5281 -13.4409
21 O1a O 13.3118 -12.7392
22 O1a O 19.3610 -17.9085
BOND 25
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 2
8 5 9 1
9 5 10 2
10 6 11 1
11 7 12 2
12 7 13 1
13 9 14 2
14 9 15 1
15 12 16 1
16 13 17 1
17 14 18 1
18 15 19 2
19 18 20 2
20 20 21 1
21 8 12 1
22 11 14 1
23 16 17 1
24 19 20 1
25 3 22 1
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