ATOM 16
1 C8y C 24.1500 -22.5400
2 N2b N 25.3400 -23.2400
3 C8x C 24.1500 -21.1400
4 C8x C 22.8900 -23.2400
5 N2b N 26.5300 -22.5400
6 C8x C 22.8900 -20.4400
7 C8x C 21.7000 -22.5400
8 C8y C 27.7200 -23.3100
9 C8x C 21.7000 -21.1400
10 C8y C 28.9800 -22.6100
11 C8x C 27.7200 -24.7100
12 C8x C 30.1700 -23.3800
13 N1a N 28.9800 -21.2100
14 C8x C 28.9100 -25.4800
15 C8y C 30.1700 -24.7800
16 N1a N 31.3600 -25.4800
BOND 17
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 3 6 2
6 4 7 1
7 5 8 1
8 6 9 1
9 8 10 2
10 8 11 1
11 10 12 1
12 10 13 1
13 11 14 2
14 12 15 2
15 15 16 1
16 7 9 2
17 14 15 1
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