ATOM 19
1 C8x C 27.2367 -21.3090
2 C8x C 27.2367 -18.5055
3 C8x C 32.1550 -18.5305
4 C8x C 32.0965 -17.1324
5 C8x C 30.8915 -16.4235
6 C8x C 29.6749 -17.1125
7 C8y C 26.0198 -20.6081
8 C8y C 26.0165 -19.2059
9 O2x O 24.6819 -18.7756
10 C1x C 23.8605 -19.9120
11 O2x O 24.6873 -21.0447
12 C8y C 28.4405 -19.2064
13 C8y C 28.4405 -20.6081
14 C1b C 29.6545 -21.3090
15 N1b N 30.8684 -20.6081
16 C8y C 30.8684 -19.2064
17 C8y C 29.6545 -18.5055
18 C1a C 32.0824 -21.3090
19 O1a O 29.6545 -22.7108
BOND 21
1 1 13 2
2 12 2 2
3 7 8 2
4 8 9 1
5 9 10 1
6 10 11 1
7 11 7 1
8 16 3 1
9 3 4 2
10 4 5 1
11 5 6 2
12 6 17 1
13 2 8 1
14 12 13 1
15 13 14 1
16 15 16 1
17 16 17 2
18 17 12 1
19 15 18 1
20 7 1 1
21 14 19 1
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