ATOM 22
1 C8y C 18.6200 -16.5200
2 C8y C 18.6200 -15.1200
3 C8y C 19.8800 -14.4200
4 C8y C 21.0700 -15.1200
5 C8y C 21.0700 -16.5200
6 C8y C 19.8800 -17.2200
7 O2x O 17.4300 -17.2200
8 C8y C 16.2400 -16.5200
9 C8x C 16.2400 -15.1200
10 C8y C 17.4300 -14.4200
11 C1x C 22.2600 -14.4200
12 C1x C 23.5200 -15.1200
13 C1x C 23.5200 -16.5200
14 C1x C 22.2600 -17.2200
15 O5x O 17.4300 -13.0200
16 C6a C 14.9800 -17.2200
17 O6a O 13.7900 -16.5200
18 O6a O 14.9800 -18.6200
19 C1b C 19.8800 -18.6200
20 O1a O 19.8800 -13.0200
21 C1b C 18.6647 -19.3151
22 C1a C 17.4763 -18.6223
BOND 24
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 2 10 1
12 4 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 5 14 1
17 10 15 2
18 8 16 1
19 16 17 1
20 16 18 2
21 6 19 1
22 3 20 1
23 19 21 1
24 21 22 1
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