HMDB0060554 RDKit 3D 4-hydroxyalprazolam 36 39 0 0 0 0 0 0 0 0999 V2000 -3.6735 0.2312 2.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1202 -0.8861 1.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4276 -2.2198 1.3293 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6424 -2.9268 0.4901 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8436 -2.0993 -0.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1585 -0.8460 0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 0.3669 -0.1082 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4422 1.3923 -0.1756 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9076 2.5951 -0.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5892 2.7255 -1.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0607 4.2550 -1.6522 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2578 1.6464 -0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1974 0.4518 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7918 -0.6065 -0.4547 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1428 -0.2215 -0.1421 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1482 -1.1950 -0.3353 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4507 -1.0176 0.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8507 0.1651 0.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9049 1.1425 0.8321 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5866 0.9214 0.4475 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4934 -1.8455 -0.7387 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7933 -2.4550 -1.1183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1787 -2.0871 -2.3958 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7568 -0.2117 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7107 0.5032 1.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9702 1.0601 2.2372 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4615 1.2592 0.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5748 3.4309 -0.7292 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2822 1.6849 -1.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8495 -2.1181 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2219 -1.7788 -0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8698 0.3106 0.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 2.0707 1.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8812 1.7013 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -3.5461 -1.0554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3828 -1.8534 -2.9380 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 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 14 21 2 0 21 22 1 0 22 23 1 0 6 2 1 0 13 7 1 0 20 15 1 0 22 5 1 0 1 24 1 0 1 25 1 0 1 26 1 0 8 27 1 0 9 28 1 0 12 29 1 0 16 30 1 0 17 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 22 35 1 0 23 36 1 0 M END