ATOM 22
1 C8x C 15.6800 -17.2200
2 C8y C 15.6800 -15.8200
3 C8y C 16.8700 -15.1200
4 C8y C 18.1300 -15.8200
5 C8y C 18.1300 -17.2200
6 C8x C 16.8700 -17.9200
7 O7x O 19.3200 -15.1200
8 C8y C 20.5100 -15.8200
9 C8x C 20.5100 -17.2200
10 C8x C 19.3200 -17.9200
11 O1a O 14.4900 -15.1200
12 O6a O 21.7000 -15.1200
13 C1b C 16.8700 -12.8100
14 C2b C 15.7500 -11.9700
15 C2c C 14.4900 -12.6700
16 C1b C 13.3000 -11.9700
17 C1b C 12.1100 -12.6700
18 C2b C 10.8500 -11.9700
19 C1a C 14.4900 -14.0000
20 C2c C 9.6600 -12.6700
21 C1a C 8.4700 -11.9700
22 C1a C 9.6600 -14.0000
BOND 23
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 5 10 1
12 2 11 1
13 8 12 2
14 3 13 1
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 1
19 17 18 1
20 15 19 1
21 18 20 2
22 20 21 1
23 20 22 1
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