ATOM 22
1 C8y C 20.9977 -19.4068
2 C8y C 20.9977 -18.0010
3 C8x C 22.1926 -17.2981
4 C8y C 23.4579 -18.0010
5 C8x C 23.4579 -19.4068
6 C8x C 22.1926 -20.1097
7 O2x O 19.6622 -19.8286
8 C1x C 18.8188 -18.7039
9 O2x O 19.6622 -17.5793
10 C1b C 24.6528 -17.2981
11 C1c C 25.9180 -18.0010
12 S4a S 27.1129 -17.2981
13 C1a C 25.9180 -19.4068
14 C1b C 28.3078 -18.0010
15 O3c O 27.1129 -15.8924
16 C1b C 29.5027 -17.2981
17 C1b C 30.6977 -18.0010
18 C1b C 31.8926 -17.2981
19 C1b C 33.0875 -18.0010
20 C1b C 34.2824 -17.2981
21 C1b C 35.4773 -18.0010
22 C1a C 36.6723 -17.2981
BOND 23
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 7 8 1
9 8 9 1
10 2 9 1
11 4 10 1
12 10 11 1
13 11 12 1
14 11 13 1
15 12 14 1
16 12 15 2
17 14 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
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