ATOM 14
1 C8y C 14.7000 -17.1500
2 C8x C 14.7000 -18.5500
3 C8y C 15.9124 -19.2500
4 C8y C 17.1249 -18.5500
5 C8x C 17.1249 -17.1500
6 C8x C 15.9124 -16.4500
7 N2b N 15.9124 -20.6498 #+
8 O3a O 14.6832 -21.3597
9 O3a O 17.1080 -21.3402 #-
10 N1b N 18.3624 -19.2500
11 C1b C 19.5749 -18.5500
12 C1b C 20.7873 -19.2500
13 O1a O 21.9997 -18.5500
14 N1a N 13.4876 -16.4500
BOND 14
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 3 7 1
8 7 8 2
9 7 9 1
10 4 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 1 14 1
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