ATOM 13
1 C8y C 27.0764 -16.3487
2 C8y C 27.1102 -17.7444
3 C8x C 28.2704 -15.6172
4 O2a O 25.8423 -15.6745
5 C8x C 28.3442 -18.4185
6 O2a O 25.9110 -18.4790
7 C8y C 29.5033 -16.2784
8 C1a C 24.6483 -16.4062
9 C8x C 29.4654 -17.6822
10 C1a C 24.6833 -17.8147
11 C1b C 30.6894 -15.5451
12 C2b C 31.9173 -16.2092
13 C2a C 33.1065 -15.4808
BOND 13
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 6 10 1
10 7 11 1
11 11 12 1
12 12 13 2
13 7 9 2
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