ATOM 21
1 C8y C 27.3043 -16.8877
2 C8y C 26.0933 -16.1857
3 C8x C 27.2926 -18.2860
4 C8x C 28.5093 -16.1916
5 C8y C 24.8764 -16.8760
6 C8x C 26.0991 -14.7817
7 C8y C 28.4976 -18.9997
8 C8x C 29.7203 -16.8994
9 C8y C 23.6714 -16.1740
10 O5x O 24.8706 -18.2800
11 O2x O 24.8881 -14.0797
12 C8y C 29.7845 -18.2977
13 O2x O 28.7901 -20.3744
14 C8y C 23.6771 -14.7759
15 C8x C 22.4662 -16.8702
16 O2x O 30.7558 -19.2394
17 C1x C 30.1883 -20.5206
18 C8x C 22.4662 -14.0739
19 C8x C 21.2552 -16.1740
20 C8y C 21.2552 -14.7759
21 O1a O 20.0385 -14.0739
BOND 24
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 2
8 5 9 1
9 5 10 2
10 6 11 1
11 7 12 2
12 7 13 1
13 9 14 2
14 9 15 1
15 12 16 1
16 13 17 1
17 14 18 1
18 15 19 2
19 18 20 2
20 20 21 1
21 8 12 1
22 11 14 1
23 16 17 1
24 19 20 1
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