ATOM 19
1 C8x C 28.6325 -20.1359
2 C8x C 27.4280 -19.4310
3 C8y C 27.4280 -18.0284
4 C8x C 28.6325 -17.3305
5 C8y C 29.8511 -19.4310
6 C8y C 29.8447 -18.0328
7 O2x O 31.1728 -17.5968
8 C1x C 32.0026 -18.7255
9 O2x O 31.1831 -19.8619
10 C8y C 26.2137 -17.3331
11 N5x N 24.9986 -18.0318
12 C8x C 24.9965 -15.2264
13 C8x C 26.2127 -15.9303
14 C8y C 23.7814 -15.9322
15 C8y C 23.7898 -17.3300
16 C8x C 22.5824 -18.0328
17 C8x C 21.3666 -17.3448
18 C8x C 21.3581 -15.9467
19 C8x C 22.5655 -15.2369
BOND 22
1 9 5 1
2 4 6 2
3 5 1 2
4 1 2 1
5 10 11 2
6 11 15 1
7 14 12 1
8 12 13 2
9 13 10 1
10 3 10 1
11 2 3 2
12 3 4 1
13 5 6 1
14 6 7 1
15 7 8 1
16 8 9 1
17 14 15 2
18 15 16 1
19 16 17 2
20 17 18 1
21 18 19 2
22 19 14 1
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