HMDB0251063 RDKit 3D Desmethyltrimipramine 45 47 0 0 0 0 0 0 0 0999 V2000 3.8052 -1.7127 1.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -0.3853 0.5527 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2661 -0.2844 -0.7642 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7932 -0.4788 -0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2187 -0.3599 -2.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1714 0.6659 0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2282 0.5389 0.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -0.6580 0.9177 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -1.2231 1.7272 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1044 -2.3829 2.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3623 -2.9236 2.2368 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2801 -2.3278 1.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9933 -1.1516 0.7158 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1625 -0.7571 -0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0542 0.2750 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2806 1.4786 -0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8736 2.6799 -1.2196 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 3.8983 -1.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0274 3.9809 -0.4565 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3992 2.8357 -0.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.6224 -0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -1.7408 2.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8363 -2.1360 1.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2096 -2.3502 0.3996 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8527 -0.0389 0.5343 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5412 0.7089 -1.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7111 -1.0288 -1.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5361 -1.4527 -0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3094 -1.3567 -2.6014 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7778 0.4089 -2.6782 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1699 -0.0139 -2.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7721 0.9790 1.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3818 1.4608 -0.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.7346 1.8207 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6432 -2.8214 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6336 -3.8444 2.7665 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -2.7920 1.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9734 -0.5004 0.6848 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5515 -1.6932 -0.5502 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1071 0.6221 -1.3085 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7247 -0.1447 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 2.5991 -1.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7615 4.8144 -1.3791 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5266 4.9337 -0.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5686 2.7911 0.4440 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 7 1 0 13 8 1 0 21 16 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 5 31 1 0 6 32 1 0 6 33 1 0 9 34 1 0 10 35 1 0 11 36 1 0 12 37 1 0 14 38 1 0 14 39 1 0 15 40 1 0 15 41 1 0 17 42 1 0 18 43 1 0 19 44 1 0 20 45 1 0 M END