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OCCC seed 42
RDKit 3D
12 11 0 0 0 0 0 0 0 0999 V2000
2.0698 -0.4322 0.3549 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9219 -0.0411 -0.2944 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2712 -0.2541 0.6228 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4906 0.2074 -0.1862 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8128 0.1355 0.0366 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8299 -0.6205 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9163 1.0332 -0.5717 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2220 0.3951 1.5147 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3720 -1.3076 0.9377 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2386 1.1899 -0.5931 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3981 0.1920 0.4461 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5582 -0.4975 -1.0403 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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