ATOM 16
1 C8x C 11.0600 -15.7500
2 C8x C 11.0600 -17.1500
3 C8x C 12.2724 -17.8500
4 C8y C 13.4849 -17.1500
5 C8y C 13.4849 -15.7500
6 C8x C 12.2724 -15.0500
7 N4x N 14.8164 -17.5826
8 C8x C 15.6393 -16.4500
9 C8y C 14.8164 -15.3174
10 C1c C 16.7781 -13.8921
11 C1b C 15.3858 -14.0384
12 O6a O 18.7399 -12.4668
13 C6a C 17.3475 -12.6131
14 N3a N 17.4781 -15.1045 #+
15 O6a O 16.6475 -11.4007
16 C3a C 17.4781 -17.0645 #-
BOND 17
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 10 11 1
12 9 11 1
13 12 13 1
14 10 13 1
15 10 14 1 #Up
16 13 15 2
17 14 16 3
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