HMDB0060957 RDKit 3D 8-hydroxymirtazapine 40 43 0 0 0 0 0 0 0 0999 V2000 4.4213 0.6523 -0.3245 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0838 0.7801 0.2213 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4204 1.9497 -0.3261 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0994 2.0685 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3668 0.8154 0.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0143 1.1299 0.4626 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2396 2.4349 0.1268 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4708 2.9705 0.0722 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5857 2.2112 0.3586 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8647 2.7469 0.3075 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4259 0.8851 0.7048 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1268 0.3770 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1393 -1.0559 1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -1.8345 0.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7971 -2.9408 -0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1132 -3.8360 -1.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2168 -3.6178 -1.2824 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8229 -2.5005 -0.7488 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1789 -1.5864 0.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0025 -0.4732 0.5165 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3604 -0.4429 -0.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4198 0.0432 -1.2461 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9146 1.6363 -0.4419 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0344 0.0671 0.4182 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0371 2.8241 -0.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 1.9395 -1.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2784 2.3964 1.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4986 2.8226 -0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6453 4.0069 -0.1949 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4482 2.7504 -0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2585 0.2277 0.9431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -1.0930 2.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1461 -1.4438 1.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -3.1603 -0.0091 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -4.7208 -1.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7609 -4.3173 -1.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8578 -2.3607 -0.9866 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2141 -0.6855 1.6099 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -0.4069 -1.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0155 -1.2594 0.2502 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 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 12 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 2 0 19 20 1 0 20 21 1 0 21 2 1 0 20 5 1 0 12 6 1 0 19 14 1 0 1 22 1 0 1 23 1 0 1 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 8 29 1 0 10 30 1 0 11 31 1 0 13 32 1 0 13 33 1 0 15 34 1 0 16 35 1 0 17 36 1 0 18 37 1 0 20 38 1 0 21 39 1 0 21 40 1 0 M END