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OCCC seed 42
RDKit 3D
12 11 0 0 0 0 0 0 0 0999 V2000
2.0487 -0.4194 0.3735 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9171 -0.0011 -0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2816 -0.2568 0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4947 0.2186 -0.1733 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8244 0.0232 -0.0074 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8397 -0.5756 -1.2298 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8975 1.0715 -0.5474 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2063 0.3311 1.5415 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3354 -1.3174 0.8847 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2506 1.2137 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4045 0.1651 0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5542 -0.4529 -1.0505 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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