HMDB0033777 RDKit 3D 3-Methyl-2-butanol 18 17 0 0 0 0 0 0 0 0999 V2000 -1.6648 0.2194 -0.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5196 0.1900 0.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7659 -0.9382 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 0.0449 -0.5709 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9856 -0.0046 0.2506 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8267 1.1948 -1.3843 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8872 -0.8310 -1.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3182 0.7301 -1.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 0.7749 -0.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5786 1.1830 0.7634 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3447 -1.8716 0.7875 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8865 -1.0501 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3798 -0.6976 2.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6585 -0.8685 -1.1626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1159 0.8633 0.9044 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8396 0.0396 -0.4864 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1119 -0.9733 0.7872 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6112 1.9948 -0.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 1 7 1 0 1 8 1 0 1 9 1 0 2 10 1 0 3 11 1 0 3 12 1 0 3 13 1 0 4 14 1 0 5 15 1 0 5 16 1 0 5 17 1 0 6 18 1 0 M END