HMDB0037050 RDKit 3D 1-Isopropyl-2-methylbenzene 24 24 0 0 0 0 0 0 0 0999 V2000 0.5748 1.9127 0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9576 0.5314 -0.1155 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 0.1906 -0.2225 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7915 -1.0949 -0.2398 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8702 -2.1271 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.8139 -0.0562 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0631 -0.4947 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3552 -0.1469 0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8111 0.1449 1.4404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 0.5025 -1.1096 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4573 2.1506 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0413 2.3717 0.9819 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 2.5283 -0.7695 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0442 1.0182 -0.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8761 -1.2551 -0.3479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2339 -3.1461 -0.1883 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2172 -2.6374 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8445 -1.2545 -0.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2734 -0.6543 2.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5353 1.0081 1.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9066 0.4706 2.0615 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2122 1.5698 -1.1398 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5651 0.1364 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1066 0.0891 -1.2521 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 10 1 0 7 2 1 0 1 11 1 0 1 12 1 0 1 13 1 0 3 14 1 0 4 15 1 0 5 16 1 0 6 17 1 0 8 18 1 0 9 19 1 0 9 20 1 0 9 21 1 0 10 22 1 0 10 23 1 0 10 24 1 0 M END