ATOM 21
1 C1y C 28.6385 -16.7337
2 C1y C 27.2991 -16.0464
3 C1y C 29.7745 -16.0338
4 C1x C 28.6197 -18.1083
5 C1z C 26.1753 -16.7400
6 C1x C 27.2865 -14.6530
7 C1z C 29.7808 -14.6404
8 C1x C 27.3752 -18.8082
9 C1y C 26.1753 -18.1147
10 C1x C 24.9819 -16.0651
11 C1a C 26.1691 -15.3841
12 C1x C 28.5624 -13.9469
13 C1a C 29.7295 -13.2407
14 C1x C 24.9819 -18.8082
15 C1x C 23.8071 -16.7400
16 C1y C 23.8071 -18.1147
17 O2a O 22.6262 -18.7895
18 O1a O 21.1015 -17.8648
19 C1x C 32.1993 -16.0448
20 C1x C 32.2056 -14.6514
21 C1x C 30.9964 -13.9459
BOND 24
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 9 14 1
14 10 15 1
15 14 16 1
16 16 17 1
17 17 18 1
18 7 12 1
19 8 9 1
20 15 16 1
21 3 19 1
22 19 20 1
23 20 21 1
24 7 21 1
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