ATOM 21
1 C1y C 18.5721 -16.1893
2 C1y C 19.7635 -16.8901
3 C1z C 17.3807 -16.8901
4 C1x C 18.5721 -14.7876
5 C1y C 20.9549 -16.1893
6 C1x C 19.6934 -18.2217
7 C1y C 17.3807 -18.2217
8 C1y C 16.2594 -16.1893
9 C1a C 17.3807 -15.4184
10 C1x C 19.7635 -14.1569
11 C1z C 20.9549 -14.7876
12 C1x C 18.5721 -18.9225
13 C1x C 16.2594 -18.9225
14 C1x C 15.0680 -16.8901
15 C1a C 20.9549 -13.4561
16 C5x C 15.0680 -18.2217
17 O5x O 13.9466 -18.8524
18 C1x C 23.3378 -16.1192
19 C1x C 23.2677 -14.7876
20 C1x C 22.1464 -14.1569
21 O1a O 16.2594 -14.7876
BOND 24
1 1 2 1
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 3 9 1
9 4 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 8 14 1
14 11 15 1
15 13 16 1
16 16 17 2
17 7 12 1
18 10 11 1
19 14 16 1
20 5 18 1
21 18 19 1
22 19 20 1
23 11 20 1
24 8 21 1
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