ATOM 12
1 O1a O 29.3284 -18.4590
2 C1y C 27.9474 -18.6541
3 C1y C 26.9929 -17.2003
4 C1y C 26.9929 -18.1967
5 C1y C 25.5972 -17.2003
6 C1z C 25.5144 -18.1967
7 N1x N 24.7905 -16.3204
8 C1x C 24.6066 -17.7788
9 C1x C 24.0908 -18.8369
10 O1a O 26.9792 -19.5211
11 O1a O 25.5012 -19.5211
12 O1a O 27.6549 -15.9741
BOND 13
1 2 4 1
2 3 5 1
3 4 6 1
4 5 7 1
5 5 8 1
6 6 9 1
7 6 7 1
8 8 9 1
9 2 1 1 #Up
10 4 10 1 #Down
11 2 3 1
12 6 11 1
13 3 12 1 #Down
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