ATOM 16
1 C5x C 23.0300 -17.1500
2 N1y N 21.9100 -16.2400
3 N2b N 20.5100 -17.0100
4 C2b C 19.3200 -16.3800
5 C8y C 18.1300 -17.0100
6 O2x O 17.0100 -16.2400
7 C8y C 15.8900 -17.0100
8 C8x C 16.3100 -18.3400
9 C8x C 17.6400 -18.3400
10 N2b N 14.6300 -16.3100 #+
11 O3a O 13.4400 -17.0100 #-
12 O3a O 14.6300 -14.9100
13 C1x C 22.4000 -14.9800
14 C1x C 23.8000 -14.9800
15 N1x N 24.2200 -16.3800
16 O5x O 23.0300 -18.5500
BOND 17
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 2
8 8 9 1
9 5 9 2
10 7 10 1
11 10 11 1
12 10 12 2
13 2 13 1
14 13 14 1
15 14 15 1
16 1 15 1
17 1 16 2
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