HMDB0031794 RDKit 3D Enilconazole 33 34 0 0 0 0 0 0 0 0999 V2000 3.5246 -2.1159 -1.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1769 -2.3083 -0.9975 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3621 -1.4999 -0.0524 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4059 -0.7386 -0.7961 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2293 0.0934 0.0638 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6845 0.0046 0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2743 -1.2462 0.6104 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6317 -1.7090 1.8189 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1892 -2.9859 1.6421 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1391 -3.2262 0.3292 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5901 -2.1887 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1525 1.5384 -0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2116 2.5364 0.7169 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2509 3.8490 0.6081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1074 4.1321 -0.4705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7061 5.7633 -0.6800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4834 3.1867 -1.3809 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9972 1.8947 -1.2232 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4136 0.6742 -2.4161 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -1.3920 -0.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1667 -2.6776 -1.6589 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7578 -3.0427 -1.6653 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0355 -0.7565 0.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8026 -2.1408 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1987 -0.0953 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9377 0.6731 1.1726 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2761 0.5214 -0.6065 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5222 -1.2288 2.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5882 -3.6393 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -2.1603 -1.3946 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8588 2.2924 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0331 4.6070 1.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1484 3.3853 -2.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 5 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 19 1 0 11 7 1 0 18 12 1 0 1 20 1 0 1 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 8 28 1 0 9 29 1 0 11 30 1 0 13 31 1 0 14 32 1 0 17 33 1 0 M END