ATOM 22
1 C8y C 31.0133 -20.8940
2 C8y C 31.0092 -22.2521
3 C8x C 23.9541 -16.8240
4 C8x C 22.7720 -16.1414
5 C8x C 21.5917 -16.8272
6 C8x C 21.5935 -18.1884
7 C8y C 23.9560 -18.1852
8 C8x C 22.7651 -18.8575
9 C1b C 29.8245 -18.8607
10 C1b C 28.6495 -18.1852
11 C1b C 27.4744 -18.8607
12 C1b C 26.2992 -18.1852
13 C1b C 25.1312 -18.8607
14 C8x C 28.6566 -20.9014
15 C8x C 28.6566 -22.2594
16 C8x C 29.8379 -22.9420
17 C8y C 29.8379 -20.2188
18 N1x N 32.2996 -22.6757
19 C5x C 33.1012 -21.5793
20 C5x C 32.3062 -20.4782
21 O5x O 34.5098 -21.5836
22 O5x O 32.7370 -19.1675
BOND 24
1 8 7 1
2 9 10 1
3 1 2 2
4 10 11 1
5 11 12 1
6 12 13 1
7 13 7 1
8 3 4 1
9 4 5 2
10 5 6 1
11 7 3 2
12 14 15 1
13 15 16 2
14 16 2 1
15 1 17 1
16 17 14 2
17 17 9 1
18 6 8 2
19 2 18 1
20 18 19 1
21 19 20 1
22 1 20 1
23 19 21 2
24 20 22 2
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