HMDB0014384 RDKit 3D Oxiconazole 39 41 0 0 0 0 0 0 0 0999 V2000 6.5576 -2.4369 1.2527 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 -1.3596 0.6126 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0148 -1.4303 1.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0612 -0.5613 0.5121 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3729 0.3770 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3802 1.3105 -1.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0771 1.1578 -0.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3779 0.0277 -0.6481 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9355 -0.1246 -0.3523 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4416 -1.4697 -0.5862 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3929 -2.1764 0.1147 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7282 -2.2585 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3287 -3.0838 0.7201 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3762 -3.5087 1.5508 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2138 -2.9649 1.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6227 1.1033 -0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2247 2.2345 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9081 3.4107 -0.9236 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0607 3.5726 -0.2035 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 5.0874 -0.2830 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.4958 2.5199 0.5587 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7738 1.3262 0.5895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3145 0.1324 1.7691 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.6862 0.4349 -0.8501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1231 1.6212 -2.0555 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.6507 -0.4194 -0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -2.1536 1.7795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0384 -0.6366 0.8697 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7594 2.3509 -0.8741 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3747 1.1435 -2.1192 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7418 -1.4167 -1.7313 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5455 -2.1969 -0.7375 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2007 -1.7273 -0.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3964 -3.3186 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2818 -3.1551 1.7092 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 2.1227 -1.4882 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 4.2314 -1.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4073 2.6252 1.1373 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6865 -0.3909 -0.6521 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 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 9 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 22 23 1 0 5 24 1 0 24 25 1 0 24 26 2 0 26 2 1 0 15 11 1 0 22 16 1 0 3 27 1 0 4 28 1 0 6 29 1 0 6 30 1 0 10 31 1 0 10 32 1 0 12 33 1 0 13 34 1 0 15 35 1 0 17 36 1 0 18 37 1 0 21 38 1 0 26 39 1 0 M END