ATOM 22
1 C8y C 26.0045 -16.9227
2 C8y C 27.1461 -17.6218
3 C8y C 24.7227 -17.6159
4 C8x C 25.9402 -15.5189
5 C8x C 28.3578 -16.9285
6 C8x C 27.1344 -19.0256
7 C8y C 23.5112 -16.9111
8 O5x O 24.7170 -19.0139
9 O2x O 24.7344 -14.8139
10 C8y C 29.5694 -17.6334
11 C8x C 28.3462 -19.7305
12 C8y C 23.5228 -15.5130
13 C8x C 22.3112 -17.6101
14 C8y C 29.5637 -19.0315
15 O2a O 30.7812 -16.9401
16 C8x C 22.3112 -14.8082
17 C8x C 21.0937 -16.9111
18 O1a O 30.7695 -19.7422
19 C1a C 31.9927 -17.6451
20 C8y C 21.0937 -15.5130
21 O2a O 19.8820 -14.8082
22 C1a C 18.6645 -15.5072
BOND 24
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 2
10 6 11 1
11 7 12 2
12 7 13 1
13 10 14 1
14 10 15 1
15 12 16 1
16 13 17 2
17 14 18 1
18 15 19 1
19 16 20 2
20 20 21 1
21 21 22 1
22 9 12 1
23 11 14 2
24 17 20 1
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