ATOM 20
1 C8y C 27.5477 -20.2489
2 C1y C 28.9375 -20.0749
3 C8y C 26.7011 -19.1237
4 N4x N 26.7365 -21.3996
5 N1y N 29.4798 -18.7842
6 C1x C 29.7865 -21.1836
7 C8y C 25.3768 -19.5856
8 C1x C 27.2468 -17.8378
9 C8y C 25.3907 -20.9877
10 C1y C 30.8581 -18.6044
11 C1x C 28.6357 -17.6721
12 C1x C 31.1729 -21.0050
13 C8x C 24.1466 -18.9014
14 C8x C 24.1908 -21.7078
15 N1y N 31.7057 -19.7214
16 C1x C 31.6564 -17.4562
17 C8x C 22.9469 -19.6215
18 C8x C 22.9652 -21.0199
19 C1x C 33.0296 -19.2596
20 C1x C 32.9949 -17.8589
BOND 24
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 9 14 1
14 10 15 1
15 10 16 1
16 13 17 2
17 14 18 2
18 15 19 1
19 16 20 1
20 7 9 2
21 8 11 1
22 12 15 1
23 17 18 1
24 19 20 1
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