ATOM 16
1 C1z C 31.2900 -15.3300
2 C1y C 29.8900 -15.3300
3 C5x C 29.4700 -14.0000
4 N1x N 30.5900 -13.1600
5 C5x C 31.7100 -14.0000
6 O5x O 28.1400 -13.5800
7 O5x O 33.0400 -13.5800
8 C1b C 29.0500 -16.4500
9 C1a C 27.6500 -16.4500
10 C8y C 32.1176 -16.4592
11 C1a C 32.6714 -15.3124
12 C8x C 33.5176 -16.4592
13 C8x C 31.4176 -17.6716
14 C8x C 32.1176 -18.8841
15 C8x C 33.5176 -18.8841
16 C8x C 34.2176 -17.6716
BOND 17
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 3 6 2
7 5 7 2
8 2 8 1
9 8 9 1
10 1 10 1
11 1 11 1
12 10 12 1
13 10 13 2
14 13 14 1
15 14 15 2
16 15 16 1
17 12 16 2
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