ATOM 22
1 C8y C 27.0230 -18.6859
2 C8y C 27.0230 -17.2876
3 C5x C 28.2341 -19.3880
4 C8y C 25.8061 -19.3880
5 O2x O 28.2341 -16.5855
6 C8x C 25.8061 -16.5855
7 C1y C 29.4453 -18.6859
8 O5x O 28.2341 -20.7865
9 C8x C 24.6009 -18.6859
10 O1a O 25.8061 -20.7865
11 C1y C 29.4453 -17.2876
12 C8y C 24.6009 -17.2876
13 O1a O 30.6623 -19.3880
14 C8y C 30.6623 -16.5855
15 O1a O 23.3839 -16.5855
16 C8x C 30.6564 -15.1873
17 C8x C 31.8675 -17.2876
18 C8y C 31.8675 -14.4909
19 C8x C 33.0846 -16.5915
20 C8y C 33.0846 -15.1873
21 O1a O 31.8675 -13.0926
22 O1a O 34.2957 -14.4909
BOND 24
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 2
8 4 9 2
9 4 10 1
10 5 11 1
11 6 12 2
12 7 13 1 #Up
13 11 14 1 #Up
14 12 15 1
15 14 16 1
16 14 17 2
17 16 18 2
18 17 19 1
19 18 20 1
20 18 21 1
21 20 22 1
22 7 11 1
23 9 12 1
24 19 20 2
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