HMDB0000227 RDKit 3D Mevalonic acid 22 21 0 0 0 0 0 0 0 0999 V2000 -0.7391 -2.0908 0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2165 -0.6033 0.3783 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0142 -0.4487 1.7261 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -0.6459 -0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9245 0.5624 -0.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3303 1.0384 0.8649 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2952 0.2265 -0.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1693 1.6760 -0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3179 2.3698 0.3903 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1215 2.4451 -0.9162 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2501 -2.1319 -0.7494 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4553 -2.3047 1.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1067 -2.7774 0.2294 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5046 0.3254 2.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9963 -1.0570 -1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6996 -1.4369 0.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 0.1993 -0.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6346 1.3530 -1.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2543 1.4036 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2696 -0.0260 0.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5258 -0.1470 -1.2738 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0766 2.0703 -0.9662 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 1 2 4 1 0 4 5 1 0 5 6 1 0 2 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 3 14 1 0 4 15 1 0 4 16 1 0 5 17 1 0 5 18 1 0 6 19 1 0 7 20 1 0 7 21 1 0 10 22 1 0 M END