ATOM 20
1 C8y C 18.2813 -16.2075
2 C8y C 18.2813 -14.8816
3 C8x C 17.1302 -16.8766
4 C8x C 17.1302 -14.2248
5 C8y C 15.9970 -16.2075
6 C8x C 15.9970 -14.8816
7 S4a S 14.8579 -16.8525
8 C1b C 13.7248 -16.1955
9 O3c O 14.8520 -18.1663
10 C1b C 12.5857 -16.8465
11 C1a C 11.4526 -16.1834
12 O3c O 14.8579 -15.4525
13 N5x N 19.5423 -16.6172
14 C8y C 20.3217 -15.5445
15 N4x N 19.5423 -14.4719
16 N1b N 21.7000 -15.5445
17 C7a C 22.3981 -16.7535
18 O7a O 23.7998 -16.7535
19 O6a O 21.7087 -17.9474
20 C1a C 24.4899 -17.9482
BOND 21
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 1 13 1
14 13 14 2
15 14 15 1
16 2 15 1
17 14 16 1
18 16 17 1
19 17 18 1
20 17 19 2
21 18 20 1
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