ATOM 20
1 C8y C 27.7629 -16.3558
2 C8y C 26.5505 -17.0614
3 C8y C 27.7687 -14.9512
4 C1y C 28.9624 -17.0614
5 C8y C 25.3321 -16.3558
6 C8y C 26.5562 -18.4602
7 C8x C 26.5505 -14.2454
8 C1x C 28.9799 -14.2511
9 C1x C 28.9624 -18.4602
10 N1x N 30.1922 -16.3675
11 C8y C 25.3380 -14.9512
12 O2x O 23.9918 -16.7809
13 C8y C 27.7629 -19.1531
14 C8x C 25.3438 -19.1474
15 C1x C 30.1979 -14.9570
16 O2x O 24.0035 -14.5203
17 C1x C 23.1695 -15.6383
18 C8x C 27.7570 -20.5461
19 C8x C 25.3438 -20.5403
20 C8x C 26.5505 -21.2401
BOND 24
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 2
11 5 12 1
12 6 13 2
13 6 14 1
14 8 15 1
15 11 16 1
16 12 17 1
17 13 18 1
18 14 19 2
19 18 20 2
20 7 11 1
21 9 13 1
22 10 15 1
23 16 17 1
24 19 20 1
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