Mrv1652303202019002D 6 6 0 0 0 0 999 V2000 0.5678 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 -0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 -0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.1143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0997 0.6294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 0.6294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3 2 2 0 0 0 0 4 1 1 0 0 0 0 5 2 1 0 0 0 0 5 4 2 0 0 0 0 6 3 1 0 0 0 0 6 4 1 0 0 0 0 M END > CDB000511 > CDB > CC1=NC=CN1 > InChI=1S/C4H6N2/c1-4-5-2-3-6-4/h2-3H,1H3,(H,5,6) > LXBGSDVWAMZHDD-UHFFFAOYSA-N > C4H6N2 > 82.1038 > 82.053098202 > 1 > 12 > 8.73834516065651 > 1 > 1 > 0 > 0 > 2-methyl-1H-imidazole > 0.36 > -0.022159476333333344 > 0.86 > 0 > 1 > 1 > 13.924598793717795 > 7.516073142342764 > 28.68 > 23.453500000000002 > 0 > 1 > 5.93e+02 g/l > 1H-imidazole, 2-methyl- > 1 > CDB000511 > 2-Methyl-1H-imidazole $$$$