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OCCC seed 42
RDKit 3D
12 11 0 0 0 0 0 0 0 0999 V2000
2.0556 -0.4296 0.3758 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9137 -0.0202 -0.3119 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2706 -0.2445 0.6141 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4968 0.2128 -0.1687 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7955 0.1262 0.0693 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8458 -0.6403 -1.2202 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9136 1.0304 -0.6104 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1953 0.3678 1.5297 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3447 -1.3091 0.9126 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2514 1.1934 -0.6085 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4088 0.1983 0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5567 -0.4849 -1.0354 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
1 5 1 0
2 6 1 0
2 7 1 0
3 8 1 0
3 9 1 0
4 10 1 0
4 11 1 0
4 12 1 0
M END
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