HMDB0014455 RDKit 3D Chlorthalidone 33 35 0 0 0 0 0 0 0 0999 V2000 2.7970 1.8846 -1.8193 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6518 0.8711 -0.7336 S 0 0 0 0 0 6 0 0 0 0 0 0 4.6627 0.0862 -1.4997 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4169 1.7601 0.2202 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -0.2342 0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.2683 -0.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3805 -1.1351 0.5512 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0683 -1.1806 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5863 -2.2294 1.1452 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4339 -1.5288 -1.0042 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3718 -0.5814 -1.4583 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9439 -0.5398 -2.5982 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5887 0.3738 -0.3782 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4357 1.4944 -0.3621 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4789 2.2484 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7073 1.9128 1.8486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8784 0.8080 1.8198 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8067 0.0050 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9333 -2.0036 1.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3019 -2.0335 1.7222 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1053 -1.1261 1.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8418 -1.1201 1.3202 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9418 2.2966 -1.3868 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4439 2.6822 -2.0697 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8205 0.4147 -0.8101 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5586 -3.0736 0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0741 -2.3517 -1.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0457 1.7531 -1.2326 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1402 3.1245 0.7727 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7819 2.5467 2.7133 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2909 0.5827 2.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3383 -2.7136 2.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7256 -2.7250 2.4388 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 2 0 2 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 7 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 21 5 1 0 18 8 1 0 18 13 1 0 1 23 1 0 1 24 1 0 6 25 1 0 9 26 1 0 10 27 1 0 14 28 1 0 15 29 1 0 16 30 1 0 17 31 1 0 19 32 1 0 20 33 1 0 M END