HMDB0014828 RDKit 3D Flurazepam 50 52 0 0 0 0 0 0 0 0999 V2000 -4.4437 2.3518 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8238 0.9562 0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9497 0.0020 -0.4289 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2259 -1.3450 -0.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5497 -1.8254 -0.7337 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6206 0.4676 -0.4013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5666 -0.4213 -0.9915 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2385 0.1165 -0.8935 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2194 1.0034 -1.9484 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3657 0.8460 -3.0282 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 2.0540 -1.8215 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5799 1.3878 -1.5586 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 0.4603 -0.6891 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2539 -0.0299 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2254 0.6798 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5075 0.2692 -1.5948 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9099 -0.9178 -1.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9864 -1.6308 -0.2781 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6892 -1.1878 -0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8676 -2.0521 0.5119 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9647 0.0192 0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5885 -0.2222 1.5475 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8372 -0.7086 2.5805 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6334 -1.0191 4.1068 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4793 -0.9631 2.4568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1669 -0.7207 1.2504 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5927 -0.2329 0.2291 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2295 3.0590 0.2137 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4238 2.5053 -1.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5071 2.6931 0.3113 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6869 0.8683 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9002 0.7983 -0.0764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -1.4005 0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4872 -2.1011 -0.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4197 -1.3343 -0.2547 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6289 -2.9061 -0.5197 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5284 -1.5977 -1.8224 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6552 1.4412 -1.0414 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3387 0.8807 0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7812 -0.3963 -2.1076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6455 -1.4877 -0.7781 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3929 2.5902 -2.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0229 2.7591 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8892 1.6242 -1.8694 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2465 0.8137 -2.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9029 -1.3132 -1.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3194 -2.5727 0.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6276 0.0185 1.6691 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1223 -1.3482 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2133 -0.9307 1.1053 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 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 13 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 23 25 2 0 25 26 1 0 26 27 2 0 27 8 1 0 19 14 1 0 27 21 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 5 37 1 0 6 38 1 0 6 39 1 0 7 40 1 0 7 41 1 0 11 42 1 0 11 43 1 0 15 44 1 0 16 45 1 0 17 46 1 0 18 47 1 0 22 48 1 0 25 49 1 0 26 50 1 0 M END