ATOM 20
1 C8x C 10.9900 -15.5400
2 C8y C 10.9900 -16.9400
3 C8x C 12.2024 -17.6400
4 C8x C 13.4149 -16.9400
5 C8y C 13.4149 -15.5400
6 C8x C 12.2024 -14.8400
7 O2a O 9.7776 -17.6400
8 C1a C 8.5821 -16.9496
9 O2a O 14.6460 -14.8290
10 C1b C 15.8512 -15.5247
11 C5a C 17.0335 -14.8419
12 N1b N 18.2275 -15.5312
13 O5a O 17.0335 -13.4402
14 C1b C 19.4154 -14.8452
15 C1b C 20.6065 -15.5329
16 N1c N 21.7959 -14.8461
17 C1b C 22.9862 -15.5334
18 C1b C 21.7960 -13.4402
19 C1a C 22.9889 -12.7514
20 C1a C 24.1761 -14.8463
BOND 20
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 2 7 1
8 7 8 1
9 5 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 11 13 2
14 12 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 16 18 1
19 18 19 1
20 17 20 1
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