ATOM 17
1 C8y C 9.8700 -17.5000
2 C8x C 9.8700 -18.9000
3 N5x N 11.0600 -19.6000
4 C8y C 12.3200 -18.9000
5 C8y C 12.3200 -17.5000
6 N5x N 11.0600 -16.8000
7 N5x N 13.6500 -19.3200
8 C8y C 14.4200 -18.2000
9 N4y N 13.6500 -17.0800
10 C3b C 8.6800 -16.8000
11 C3a C 7.4200 -16.1000
12 O1a O 15.8200 -18.2000
13 C1c C 14.0700 -15.7500
14 C1b C 15.4700 -15.4700
15 C1a C 16.3800 -16.5200
16 C1b C 13.1600 -14.7000
17 C1a C 11.7600 -14.9800
BOND 18
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 4 7 1
8 7 8 2
9 8 9 1
10 5 9 1
11 1 10 1
12 10 11 3
13 8 12 1
14 9 13 1
15 13 14 1
16 14 15 1
17 13 16 1
18 16 17 1
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