ATOM 16
1 C1z C 20.4400 -18.5500
2 C5x C 19.0400 -18.5500
3 N1y N 20.9300 -17.2200
4 N1x N 18.6900 -17.2200
5 O5x O 18.2000 -19.6700
6 C5x C 19.8100 -16.3800
7 O5x O 19.8100 -14.9800
8 C8y C 21.8400 -18.5500
9 C8x C 22.5400 -19.7400
10 C8x C 23.9400 -19.7400
11 C8x C 24.6400 -18.5500
12 C8x C 23.9400 -17.2900
13 C8x C 22.5400 -17.2900
14 C1b C 20.4400 -19.9500
15 C1a C 19.1800 -20.6500
16 C1a C 22.2727 -16.8235
BOND 17
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 2
5 3 6 1
6 6 7 2
7 4 6 1
8 1 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 1 14 1
16 14 15 1
17 3 16 1
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