ATOM 20
1 C8y C 30.4645 -20.2156
2 C8x C 30.4645 -21.6123
3 O7x O 31.6744 -19.5084
4 C8y C 31.6801 -22.3136
5 C8y C 32.8899 -20.2098
6 C8x C 32.8959 -21.6123
7 O1a O 31.6801 -23.7163
8 O6a O 34.1114 -19.5025
9 C1b C 29.2517 -19.5196
10 C5a C 28.0426 -20.2220
11 C2b C 26.8299 -19.5261
12 O5a O 28.0463 -21.6203
13 C2b C 26.8261 -18.1278
14 C8y C 25.6133 -17.4319
15 C8x C 25.6119 -16.0349
16 C8x C 24.3992 -15.3390
17 C8y C 23.1901 -16.0414
18 C8x C 23.1938 -17.4397
19 C8x C 24.4067 -18.1356
20 O1a O 21.9772 -15.3455
BOND 21
1 9 10 1
2 1 3 1
3 10 11 1
4 2 4 1
5 10 12 2
6 3 5 1
7 11 13 2
8 4 6 2
9 13 14 1
10 4 7 1
11 5 8 2
12 5 6 1
13 1 9 1
14 14 15 2
15 15 16 1
16 16 17 2
17 17 18 1
18 18 19 2
19 19 14 1
20 1 2 2
21 17 20 1
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