HMDB0258569 RDKit 3D Sulconazole 39 41 0 0 0 0 0 0 0 0999 V2000 5.2254 -2.9662 -2.0602 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.3295 -1.6727 -1.3399 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0852 -0.4602 -1.9468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3677 0.5146 -1.3084 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8499 0.3242 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1191 1.4367 0.6404 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4003 1.5283 0.3104 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6859 0.3151 1.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -1.0482 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8889 -1.2094 -0.9316 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0092 -1.1602 -1.9778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6911 -1.3701 -3.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9576 -1.5422 -2.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0864 -1.4470 -1.4702 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 0.8682 1.2932 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1317 0.0882 1.3484 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3932 0.6332 1.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4973 1.9683 1.8592 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0649 2.6814 2.2179 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.3846 2.7886 1.8103 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1385 2.2116 1.5219 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7089 3.2185 1.4527 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1006 -0.8756 0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8136 -1.8356 -0.0723 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4883 -0.3216 -2.9494 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1723 1.4740 -1.7852 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3811 1.3755 1.7347 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6744 2.3736 0.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2682 0.1711 2.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4099 -1.4622 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3405 -1.7093 1.0195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -0.9880 -1.8493 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3083 -1.3960 -4.1566 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0749 -1.5690 -1.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1295 -0.9738 1.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2821 0.0228 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4588 3.8499 1.9873 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7172 -1.0560 1.5666 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9792 -2.7805 0.4536 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 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 8 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 21 22 1 0 5 23 1 0 23 24 2 0 24 2 1 0 14 10 1 0 21 15 1 0 3 25 1 0 4 26 1 0 6 27 1 0 6 28 1 0 8 29 1 0 9 30 1 0 9 31 1 0 11 32 1 0 12 33 1 0 14 34 1 0 16 35 1 0 17 36 1 0 20 37 1 0 23 38 1 0 24 39 1 0 M END