HMDB0248765 RDKit 3D Azapropazone 42 44 0 0 0 0 0 0 0 0999 V2000 5.0861 1.3998 -0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6419 0.9594 -0.0649 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1888 0.6089 1.3322 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7598 0.1585 1.3785 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4854 -1.0320 0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2225 -1.9978 0.2465 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1185 -0.9104 0.1677 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8556 -1.8230 -0.3247 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5163 -3.1970 -0.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -4.1087 0.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0862 -3.6274 -1.7387 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0605 -1.4785 -0.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5327 -0.1425 -0.5021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8297 0.1856 -0.8394 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2363 1.4965 -0.6961 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3461 2.4386 -0.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8229 3.8299 -0.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0542 2.1133 0.1125 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6384 0.8052 -0.0274 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2889 0.4271 0.3161 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8256 1.1571 0.8146 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 2.4089 0.7539 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2105 2.4764 -0.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6593 0.8189 -0.7878 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5036 1.2247 0.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0509 1.8381 -0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5004 0.1440 -0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2735 1.5171 1.9634 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8232 -0.1676 1.7617 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4993 -0.0434 2.4266 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6135 -5.1626 0.2922 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8531 -3.9665 0.8769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -3.8728 1.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -3.8565 -1.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0365 -2.8143 -2.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4485 -4.4911 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5354 -0.5454 -1.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2663 1.7818 -0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7303 4.0187 -0.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0386 4.5005 -0.4533 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0958 4.0801 0.9734 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3479 2.8484 0.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 8 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 2 0 21 4 1 0 20 7 1 0 19 13 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 10 31 1 0 10 32 1 0 10 33 1 0 11 34 1 0 11 35 1 0 11 36 1 0 14 37 1 0 15 38 1 0 17 39 1 0 17 40 1 0 17 41 1 0 18 42 1 0 M END