HMDB0254498 RDKit 3D Metaflumizone 52 54 0 0 0 0 0 0 0 0999 V2000 -1.9434 -6.6998 1.3295 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1004 -5.5995 0.9975 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3281 -4.2453 0.5651 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5219 -3.6887 -0.3847 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7852 -2.4167 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8219 -1.6597 -0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0461 -0.3286 -0.8376 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3747 0.8130 -0.2757 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4605 0.7963 0.5627 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 -0.3734 1.1149 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3763 -0.5322 0.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 0.4903 -0.1088 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1945 -1.5858 1.1191 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6283 -1.4327 0.8513 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1845 -0.1981 1.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4799 0.1405 0.8102 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2865 -0.8517 0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5597 -0.4626 -0.0853 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6976 -0.5586 0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7563 -0.0099 -0.0276 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0775 -1.9103 0.8915 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6186 -0.0213 1.9394 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7278 -2.0786 -0.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3994 -2.4008 0.2594 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6965 2.1572 -0.8123 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5711 2.3289 -1.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8351 3.5992 -2.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2288 4.6970 -1.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3525 4.5335 -0.7143 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6856 5.7156 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5755 6.7747 -0.8944 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 6.0341 0.9967 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4543 5.3159 0.3743 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0996 3.2542 -0.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6302 -2.2364 0.6643 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3875 -3.5306 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -4.3003 -0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1158 -2.0008 -1.5646 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9173 -0.3950 -1.9717 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1681 -0.1719 -0.7746 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6787 1.4364 0.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8062 -2.4342 1.5625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5483 0.5540 1.5722 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9117 1.1238 1.0242 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3241 -2.8357 -0.5207 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9635 -3.3816 0.0417 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0898 1.5282 -2.3608 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5244 3.7470 -3.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3891 5.7251 -2.1084 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3903 3.1675 0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4402 -1.6463 1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0319 -3.9456 1.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 3 9 10 1 0 10 11 2 3 11 12 1 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 1 0 19 20 1 0 19 21 1 0 19 22 1 0 17 23 1 0 23 24 2 0 8 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 29 34 2 0 6 35 1 0 35 36 2 0 36 3 1 0 24 14 1 0 34 25 1 0 4 37 1 0 5 38 1 0 7 39 1 0 7 40 1 0 12 41 1 0 13 42 1 0 15 43 1 0 16 44 1 0 23 45 1 0 24 46 1 0 26 47 1 0 27 48 1 0 28 49 1 0 34 50 1 0 35 51 1 0 36 52 1 0 M END