ATOM 22
1 C8y C 25.9280 -17.0328
2 C8y C 27.1450 -16.3364
3 C8y C 25.9338 -18.4312
4 C8y C 24.7108 -16.3364
5 C1y C 28.3563 -17.0328
6 C8y C 27.1510 -14.9321
7 C8y C 27.1393 -19.1334
8 C8x C 24.7285 -19.1275
9 C8y C 24.7168 -14.9321
10 O2x O 23.3767 -16.7635
11 C1x C 28.3505 -18.4312
12 N1y N 29.5792 -16.3481
13 C8x C 25.9338 -14.2241
14 C1x C 28.3737 -14.2299
15 C8x C 27.1393 -20.5261
16 C8y C 24.7225 -20.5201
17 O2x O 23.3884 -14.4990
18 C1x C 22.5634 -15.6225
19 C1x C 29.5909 -14.9380
20 C1a C 30.7905 -17.0445
21 C8x C 25.9280 -21.2106
22 O1a O 23.4938 -21.1989
BOND 26
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 2
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 2
13 6 14 1
14 7 15 1
15 8 16 2
16 9 17 1
17 10 18 1
18 12 19 1
19 12 20 1
20 15 21 2
21 16 22 1
22 7 11 1
23 9 13 1
24 14 19 1
25 16 21 1
26 17 18 1
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