HMDB0032627 RDKit 3D 1-Methyl-2-propylbenzene 24 24 0 0 0 0 0 0 0 0999 V2000 -2.4423 0.5566 0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0045 -0.7943 0.0198 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9757 -0.6214 -1.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2215 0.0896 -0.5617 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 1.4345 -0.8904 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 2.1501 -0.4654 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4436 1.5392 0.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2893 0.2119 0.6227 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1928 -0.5404 0.2056 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0631 -1.9739 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4838 0.4254 0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7973 0.8403 1.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4185 1.3474 -0.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8797 -1.3263 -0.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6611 -1.4637 0.8162 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4198 -0.0526 -1.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6847 -1.6072 -1.4565 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4306 1.8954 -1.5005 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 3.1954 -0.7389 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3114 2.0997 0.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0277 -0.3355 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6744 -2.5801 -0.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1199 -2.3222 0.7768 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4982 -2.1683 1.4854 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 4 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 5 18 1 0 6 19 1 0 7 20 1 0 8 21 1 0 10 22 1 0 10 23 1 0 10 24 1 0 M END