ATOM 21
1 C8y C 25.0247 -17.1993
2 C8y C 26.4165 -17.1857
3 C8y C 24.3242 -15.9874
4 C8y C 24.3394 -18.4147
5 C8y C 27.1193 -15.9869
6 C8x C 27.1118 -18.3947
7 C8x C 22.9175 -15.9924
8 C8x C 25.0227 -14.7729
9 C8x C 22.9346 -18.4273
10 O2a O 25.0400 -19.6265
11 C8x C 26.4269 -14.7729
12 C8x C 28.5155 -15.9893
13 C8y C 28.5023 -18.4072
14 C8y C 22.2241 -17.2099
15 C1a C 26.4445 -19.6136
16 C8y C 29.2030 -17.2005
17 O2a O 29.1998 -19.6241
18 O2a O 20.8193 -17.2226
19 O1a O 30.6090 -17.2086
20 C1a C 30.6010 -19.6294
21 C1a C 20.1085 -16.0051
BOND 23
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 3 8 1
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 2
13 7 14 2
14 10 15 1
15 12 16 2
16 13 17 1
17 14 18 1
18 16 19 1
19 17 20 1
20 18 21 1
21 8 11 2
22 9 14 1
23 13 16 1
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