ATOM 20
1 N5x N 27.9144 -19.1562
2 C8y C 27.9144 -16.3561
3 C8y C 26.7053 -17.0526
4 C8y C 26.7112 -18.4527
5 C8y C 25.5007 -19.1614
6 C8x C 25.4889 -16.3614
7 C8y C 29.1308 -18.4527
8 C8y C 29.1340 -17.0521
9 C8x C 30.4675 -16.6246
10 C8x C 31.2837 -17.7610
11 O2x O 30.4621 -18.8934
12 C8y C 24.2784 -17.0629
13 C8y C 24.2811 -18.4671
14 O2x O 22.9460 -18.9085
15 C1x C 22.1229 -17.7726
16 O2x O 22.9418 -16.6337
17 O2a O 27.9207 -14.9631
18 C1a C 26.7107 -14.2595
19 O2a O 25.5146 -20.5492
20 C1a C 26.7318 -21.2317
BOND 23
1 3 2 1
2 7 8 1
3 8 9 1
4 9 10 2
5 10 11 1
6 11 7 1
7 3 4 2
8 4 5 1
9 5 13 2
10 12 6 2
11 6 3 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 12 1
17 2 8 2
18 2 17 1
19 17 18 1
20 7 1 2
21 5 19 1
22 1 4 1
23 19 20 1
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