HMDB0254585 RDKit 3D Methyl diethyldithiocarbamate 22 21 0 0 0 0 0 0 0 0999 V2000 -1.5416 -1.8467 0.9075 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8137 -0.6093 1.3899 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4577 0.2413 0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5737 0.8598 -0.4001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2919 1.5846 -1.6801 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8703 0.3595 -0.1161 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3736 1.3089 -1.3257 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1219 -0.5601 0.7991 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7589 -0.2597 0.1173 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -2.3803 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7135 -2.4832 1.7965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5372 -1.6299 0.4691 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0571 -0.9184 1.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4929 -0.0171 2.0731 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0565 1.5980 0.2976 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3877 0.1162 -0.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7923 2.5459 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7671 0.9097 -2.4181 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3317 1.7829 -2.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4517 0.1961 0.8816 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7833 0.4194 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2129 -1.2180 -0.1936 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 4 5 1 0 3 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 1 10 1 0 1 11 1 0 1 12 1 0 2 13 1 0 2 14 1 0 4 15 1 0 4 16 1 0 5 17 1 0 5 18 1 0 5 19 1 0 9 20 1 0 9 21 1 0 9 22 1 0 M END