ATOM 21
1 C8y C 15.9128 -15.6038
2 C1b C 17.1236 -16.2959
3 C8x C 14.6954 -16.3150
4 C8x C 15.9128 -14.1943
5 C8y C 18.3218 -15.5974
6 C8y C 13.4846 -15.6038
7 C8y C 14.6954 -13.4961
8 C8y C 19.5327 -16.3085
9 C8x C 18.3218 -14.1880
10 C8y C 13.4846 -14.1943
11 O2a O 12.2737 -16.2959
12 O2a O 14.6891 -12.2457
13 N5x N 20.7563 -15.5974
14 N1a N 19.5262 -17.7688
15 N5x N 19.5327 -13.4896
16 O2a O 12.2800 -13.4961
17 C1a C 11.1457 -15.5909
18 C1a C 15.8936 -11.5410
19 C8y C 20.7563 -14.1880
20 C1a C 12.2800 -12.0357
21 N1a N 21.9609 -13.4833
BOND 22
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 3 6 2
6 4 7 1
7 5 8 2
8 5 9 1
9 6 10 1
10 6 11 1
11 7 12 1
12 8 13 1
13 8 14 1
14 9 15 2
15 10 16 1
16 11 17 1
17 12 18 1
18 13 19 2
19 16 20 1
20 19 21 1
21 7 10 2
22 15 19 1
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