ATOM 20
1 C8x C 23.4551 -18.6255
2 C8x C 23.4551 -20.0260
3 C8x C 24.6680 -20.7263
4 C8y C 25.8809 -20.0260
5 C8y C 25.8809 -18.6255
6 C8x C 24.6680 -17.9253
7 C7a C 27.1124 -17.9143
8 C7a C 27.1124 -20.7373
9 O6a O 28.3180 -18.6102
10 O7a O 27.1121 -16.5249
11 O6a O 28.3180 -20.0413
12 O7a O 27.1121 -22.1266
13 C1b C 28.3130 -22.8204
14 C1b C 28.3130 -15.8312
15 C1c C 29.4959 -16.5140
16 C1a C 30.6862 -15.8265
17 C1a C 29.4962 -17.9198
18 C1c C 29.5007 -22.1346
19 C1a C 30.6838 -22.8176
20 C1a C 29.5010 -20.7203
BOND 20
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 5 7 1
8 4 8 1
9 7 9 2
10 7 10 1
11 8 11 2
12 8 12 1
13 12 13 1
14 10 14 1
15 14 15 1
16 15 16 1
17 15 17 1
18 13 18 1
19 18 19 1
20 18 20 1
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