ATOM 22
1 C8y C 27.2794 -14.7104
2 C1y C 28.5346 -15.4077
3 C8y C 26.0938 -15.4077
4 C8y C 27.2794 -13.3156
5 C8y C 24.9083 -14.7104
6 O1a O 26.0938 -16.8722
7 O7x O 26.0938 -12.5485
8 O6a O 28.4649 -12.6182
9 C8y C 24.9083 -13.3156
10 C8x C 23.6530 -15.4077
11 C8x C 23.6530 -12.6182
12 C8x C 22.4675 -14.7104
13 C8x C 22.4675 -13.3156
14 C8y C 28.5577 -16.8023
15 C8y C 29.7769 -17.4796
16 C1x C 30.9731 -16.7624
17 C1x C 30.9500 -15.3679
18 C1x C 29.7308 -14.6905
19 C8x C 27.3615 -17.5195
20 C8x C 27.3845 -18.9140
21 C8x C 28.6037 -19.5914
22 C8x C 29.7299 -18.8742
BOND 25
1 1 2 1
2 1 3 2
3 1 4 1
4 3 5 1
5 3 6 1
6 4 7 1
7 4 8 2
8 5 9 2
9 5 10 1
10 9 11 1
11 10 12 2
12 11 13 2
13 7 9 1
14 12 13 1
15 2 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 2 18 1
21 14 19 2
22 19 20 1
23 20 21 2
24 21 22 1
25 15 22 2
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