HMDB0000990 RDKit 3D Acetaldehyde 7 6 0 0 0 0 0 0 0 0999 V2000 -0.6415 0.0087 -0.0155 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8348 -0.0103 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5046 -1.0301 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9489 0.6840 -0.8501 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9979 0.3757 0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0953 -0.9714 -0.1972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3442 0.9434 0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 1 4 1 0 1 5 1 0 1 6 1 0 2 7 1 0 M END