ATOM 15
1 C1y C 25.5842 -16.5836
2 C1y C 24.4021 -17.2679
3 C1y C 25.5842 -15.2337
4 C1y C 23.2264 -16.5836
5 O1a O 24.4021 -18.6874
6 O2x O 24.4021 -14.5558
7 N1a N 26.8932 -14.3463
8 C1y C 23.2264 -15.2337
9 O1a O 22.0693 -17.2679
10 C1b C 22.0693 -14.5558
11 O1a O 21.0367 -15.4328
12 N1b N 26.7738 -17.2700
13 C5a C 27.9524 -16.5900
14 C1a C 29.1649 -17.2900
15 O5a O 27.9527 -15.6102
BOND 15
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1 #Up
5 3 6 1
6 3 7 1 #Up
7 4 8 1
8 4 9 1 #Down
9 8 10 1 #Up
10 10 11 1
11 6 8 1
12 1 12 1 #Down
13 12 13 1
14 13 14 1
15 13 15 2
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