HMDB0014649 RDKit 3D Nitazoxanide 30 31 0 0 0 0 0 0 0 0999 V2000 1.5278 3.2726 -1.1691 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1694 2.6311 0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9606 2.5099 1.0614 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1339 2.1194 0.3115 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4384 1.5195 1.5378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5927 2.3768 2.6198 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8896 1.8979 3.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0271 0.5464 4.0152 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8756 -0.2948 2.9498 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5726 0.1662 1.6554 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4687 -0.7860 0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6029 -2.0235 0.9141 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2375 -0.4675 -0.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1502 -1.5309 -1.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2659 -2.8289 -1.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1605 -3.6384 -2.5791 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0729 -3.0990 -3.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2268 -3.7623 -5.0640 N 0 0 0 0 0 4 0 0 0 0 0 0 0.1470 -4.9969 -5.0918 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -3.0899 -6.2274 O 0 0 0 0 0 1 0 0 0 0 0 0 0.1252 -1.4158 -3.4365 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3407 4.0187 -1.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 3.7987 -1.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8603 2.5123 -1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4785 3.4483 2.4866 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 2.5745 4.7056 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2625 0.1774 5.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9923 -1.3784 3.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1225 0.4798 -1.1082 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2513 -4.7372 -2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 17 21 1 0 10 5 1 0 21 14 1 0 1 22 1 0 1 23 1 0 1 24 1 0 6 25 1 0 7 26 1 0 8 27 1 0 9 28 1 0 13 29 1 0 16 30 1 0 M CHG 2 18 1 20 -1 M END