ATOM 21
1 C8y C 18.8657 -16.2275
2 C8y C 18.8657 -14.9003
3 C8x C 17.7135 -16.8973
4 C8x C 17.7135 -14.2429
5 C8y C 16.5791 -16.2275
6 C8x C 16.5791 -14.9003
7 S4a S 15.4389 -16.8732
8 C1b C 14.3047 -16.2155
9 O3c O 15.4330 -18.1883
10 C1b C 13.1644 -16.8672
11 C1b C 12.0302 -16.2034
12 O3c O 15.4389 -15.4718
13 O1a O 10.8389 -16.8819
14 N5x N 20.1280 -16.6377
15 C8y C 20.9081 -15.5639
16 N4x N 20.1280 -14.4902
17 N1b N 22.3298 -15.5643
18 C7a C 23.0190 -16.7587
19 O7a O 24.4297 -16.7592
20 O6a O 22.3338 -17.9446
21 C1a C 25.1168 -17.9500
BOND 22
1 1 2 2
2 1 3 1
3 2 4 1
4 3 5 2
5 4 6 2
6 5 7 1
7 7 8 1
8 7 9 2
9 8 10 1
10 10 11 1
11 5 6 1
12 7 12 2
13 11 13 1
14 1 14 1
15 14 15 2
16 15 16 1
17 2 16 1
18 15 17 1
19 17 18 1
20 18 19 1
21 18 20 2
22 19 21 1
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