ATOM 15
1 C1y C 25.3327 -18.3109
2 C1y C 26.5052 -17.6312
3 C1y C 25.3327 -19.6829
4 C1y C 27.6964 -18.3109
5 O1a O 26.5052 -16.2778
6 C1y C 26.5052 -20.3752
7 O1a O 24.1541 -20.3566
8 C1y C 27.6964 -19.6829
9 O1a O 28.8689 -17.6312
10 O1a O 26.5052 -21.7348
11 O1a O 28.8751 -20.3566
12 N1b N 24.1377 -17.6227
13 C2c C 22.9376 -18.3400
14 N1a N 21.7251 -17.6400
15 N2a N 22.9376 -19.5300
BOND 15
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1 #Down
5 3 6 1
6 3 7 1 #Down
7 4 8 1
8 4 9 1 #Up
9 6 10 1 #Up
10 8 11 1 #Down
11 6 8 1
12 1 12 1 #Up
13 12 13 1
14 13 14 1
15 13 15 2
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