ATOM 18
1 C1z C 25.7125 -18.6779
2 C8y C 26.9172 -17.9703
3 C5x C 25.7125 -20.0815
4 C5x C 24.4727 -17.9937
5 C1b C 26.9114 -19.3739
6 C8x C 28.1278 -18.6546
7 C8x C 26.9697 -16.5666
8 N1y N 24.4727 -20.7833
9 O5x O 26.9055 -20.7833
10 N1x N 23.2678 -18.6779
11 O5x O 24.4727 -16.5783
12 C1a C 28.3151 -19.3739
13 C8x C 29.3327 -17.9469
14 C8x C 28.1044 -15.8591
15 C5x C 23.2678 -20.0815
16 C1a C 24.5310 -22.1870
17 C8x C 29.3210 -16.5492
18 O5x O 22.0572 -20.7776
BOND 19
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 2
9 4 10 1
10 4 11 2
11 5 12 1
12 6 13 1
13 7 14 2
14 8 15 1
15 8 16 1
16 13 17 2
17 15 18 2
18 10 15 1
19 14 17 1
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