HMDB0015264 RDKit 3D Pioglitazone 45 47 0 0 0 0 0 0 0 0999 V2000 7.8653 -0.3007 -0.7326 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7813 0.0114 -1.7351 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4785 0.0528 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7359 -1.0849 -0.8684 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -1.0158 -0.1783 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1054 0.1773 0.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8232 0.2889 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -1.0628 1.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0428 -1.0378 1.7857 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1923 -0.3927 1.4053 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2823 -0.4851 2.2698 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4648 0.1420 1.9345 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6121 0.8547 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8779 1.4915 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6516 0.6702 -0.5313 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2465 1.5095 -0.9557 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2301 0.0362 -1.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4286 -0.0222 -1.3311 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3636 -1.0189 -0.7366 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1771 -0.6160 -0.0555 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -1.3257 0.8747 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5275 0.9333 -0.0573 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3368 0.3197 0.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8528 1.3147 0.2052 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0122 1.2165 -0.4613 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8653 -0.0395 -1.1796 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9241 -1.3902 -0.5099 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7324 0.3095 0.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9519 1.0099 -2.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 -0.7704 -2.5156 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0632 -2.0424 -1.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9424 -1.9337 -0.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2201 1.0912 0.6865 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0658 0.5933 2.1627 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0009 -1.4594 0.0893 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8959 -1.7780 1.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1678 -1.0474 3.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2655 0.0523 2.6535 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6019 2.4661 -0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4936 1.7475 1.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1249 0.5670 -1.5128 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5095 -2.0522 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5948 1.4986 -1.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5415 0.4110 -0.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6239 2.1108 -0.5825 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 2 0 13 22 1 0 22 23 2 0 6 24 1 0 24 25 2 0 25 3 1 0 23 10 1 0 20 15 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 4 31 1 0 5 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 11 37 1 0 12 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 19 42 1 0 22 43 1 0 23 44 1 0 25 45 1 0 M END