ATOM 21
1 C2y C 21.5507 -16.1926
2 C1z C 20.3301 -15.4918
3 C2y C 21.5507 -17.5943
4 C2b C 22.7597 -15.4975
5 C1x C 19.1153 -16.1926
6 C1a C 19.1094 -14.7850
7 C1a C 21.5390 -14.7792
8 C2x C 20.3301 -18.3010
9 C1a C 22.7537 -18.3010
10 C2b C 23.9744 -16.1984
11 C2x C 19.1153 -17.5943
12 C2c C 25.1834 -15.5035
13 C2b C 26.3982 -16.2043
14 C1a C 25.1776 -14.1018
15 C2b C 27.6130 -15.5152
16 C2b C 28.8279 -16.2160
17 C2c C 28.8219 -17.6235
18 C2b C 30.0250 -18.3186
19 C1a C 27.6013 -18.3126
20 C2b C 30.0192 -19.7260
21 R R 31.2282 -20.3510
BOND 21
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 2
10 5 11 1
11 10 12 1
12 12 13 2
13 12 14 1
14 13 15 1
15 15 16 2
16 16 17 1
17 17 18 2
18 17 19 1
19 18 20 1
20 20 21 2
21 8 11 2
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