HMDB0015256 RDKit 3D Tolbutamide 36 36 0 0 0 0 0 0 0 0999 V2000 -5.5111 1.4877 -0.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0301 0.3772 -1.3332 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0454 -0.5468 -0.6891 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7788 0.1055 -0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9348 -0.9103 0.3729 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.6415 0.9226 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1374 0.5069 0.9326 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0826 -1.7235 1.4784 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -1.5393 2.1721 S 0 0 0 0 0 6 0 0 0 0 0 0 2.2202 -2.8739 2.5416 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5148 -0.7573 3.4639 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7413 -0.6716 1.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4414 -1.3926 0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3059 -0.7008 -0.6482 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4519 0.6654 -0.5131 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3819 1.4185 -1.3947 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7544 1.3899 0.4293 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8903 0.6935 1.2479 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5942 1.6425 -0.7114 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9364 2.3945 -0.6626 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3823 1.2284 0.6256 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6128 0.8569 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -0.2388 -1.7132 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7918 -1.3981 -1.3409 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5346 -0.9615 0.2398 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2295 0.6281 -1.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9611 0.8599 0.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2926 -1.8895 0.4001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3294 -2.7031 1.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3534 -2.4600 0.0369 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8953 -1.2060 -1.4186 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9477 2.1017 -0.7342 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0714 0.6755 -1.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8176 1.9587 -2.1751 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 2.4436 0.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2911 1.1802 2.0289 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 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 2 0 9 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 18 12 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 8 29 1 0 13 30 1 0 14 31 1 0 16 32 1 0 16 33 1 0 16 34 1 0 17 35 1 0 18 36 1 0 M END