ATOM 21
1 C1x C 13.7996 -14.7839
2 C1x C 13.7996 -16.1852
3 C1y C 15.0132 -16.8859
4 C1y C 16.2268 -16.1852
5 C2x C 16.2268 -14.7839
6 C2y C 15.0132 -14.0833
7 C8y C 17.4590 -16.8969
8 C8y C 17.4587 -18.2871
9 C8x C 18.6721 -18.9880
10 C8y C 19.8859 -18.2877
11 C8x C 19.8862 -16.8975
12 C8y C 18.6727 -16.1965
13 C1a C 15.0132 -12.6822
14 O1a O 17.4587 -19.6883
15 O1a O 18.6728 -14.7843
16 C1b C 21.1061 -18.9925
17 C1b C 22.3069 -18.2995
18 C1a C 23.4929 -18.9845
19 C2c C 15.0132 -18.2870
20 C2a C 13.7828 -18.9975
21 C1a C 16.2099 -18.9780
BOND 22
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1 #Up
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 6 13 1
15 8 14 1
16 12 15 1
17 10 16 1
18 16 17 1
19 17 18 1
20 3 19 1 #Down
21 19 20 2
22 19 21 1
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