ATOM 23
1 C2y C 21.9877 -18.8182
2 C5x C 20.7731 -18.1235
3 C2y C 21.9877 -20.2255
4 C1b C 23.1847 -18.1235
5 C2y C 19.5528 -18.8182
6 O5x O 20.7731 -16.7162
7 C5x C 20.7731 -20.9262
8 O1a O 23.1962 -20.9262
9 C1b C 24.3991 -18.8125
10 C2x C 19.5528 -20.2255
11 O1a O 18.3384 -18.1175
12 O5x O 20.7731 -22.3333
13 C1b C 25.6135 -18.1118
14 C1b C 26.8281 -18.8065
15 C1b C 28.0425 -18.1059
16 C1b C 29.2571 -18.8008
17 C1b C 30.4657 -18.1001
18 C1b C 31.6801 -18.7891
19 C1b C 32.8888 -18.0942
20 C1b C 34.1032 -18.7832
21 C1b C 35.3119 -18.0884
22 C1b C 36.5265 -18.7774
23 C1a C 37.7409 -18.0767
BOND 23
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 3 8 1
8 4 9 1
9 5 10 2
10 5 11 1
11 7 12 2
12 9 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 22 23 1
23 7 10 1
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