ATOM 19
1 C8y C 18.7896 -18.4201
2 C8y C 20.1251 -17.9985
3 C8x C 18.0165 -17.2956
4 C8y C 20.1251 -16.5927
5 C8x C 21.3200 -18.7013
6 C8x C 18.7896 -16.1710
7 C8y C 21.3200 -15.8898
8 O2x O 22.5852 -17.9985
9 C8x C 22.5852 -16.5927
10 C4a C 18.2976 -19.7557
11 C1b C 21.3198 -14.4840
12 O4a O 16.9622 -20.0368
13 O7a O 22.4880 -13.7527
14 C7a C 23.6972 -14.3938
15 C1b C 24.8946 -13.6431
16 O6a O 23.7483 -15.8199
17 C1c C 26.1543 -14.3106
18 C1a C 27.3729 -13.5472
19 C1a C 26.2045 -15.6798
BOND 20
1 2 4 1
2 2 5 2
3 3 6 1
4 4 7 1
5 5 8 1
6 7 9 2
7 4 6 2
8 8 9 1
9 1 2 1
10 1 3 2
11 1 10 1
12 7 11 1
13 10 12 2
14 11 13 1
15 13 14 1
16 14 15 1
17 14 16 2
18 15 17 1
19 17 18 1
20 17 19 1
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