ATOM 21
1 C8y C 27.7966 -15.6052
2 C8y C 26.5798 -16.3073
3 C1y C 28.9960 -16.3133
4 C8y C 27.8026 -14.2010
5 C8y C 26.5855 -17.7115
6 C8y C 25.3627 -15.6052
7 C1x C 28.9960 -17.7115
8 N1x N 30.2248 -15.6169
9 C8x C 26.5855 -13.4991
10 C1x C 29.0137 -13.5049
11 C8y C 27.7909 -18.4019
12 C8x C 25.3804 -18.4019
13 C8y C 25.3687 -14.2070
14 O2x O 24.0288 -16.0382
15 C1x C 30.2305 -14.2128
16 C8x C 27.7909 -19.7944
17 C8x C 25.4444 -19.7886
18 O2x O 24.0405 -13.7682
19 C1x C 23.2038 -14.9031
20 C8y C 26.5798 -20.4905
21 O1a O 26.5738 -21.8947
BOND 25
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
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 2
17 13 18 1
18 14 19 1
19 16 20 2
20 20 21 1
21 7 11 1
22 9 13 1
23 10 15 1
24 17 20 1
25 18 19 1
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