HMDB0015282 RDKit 3D Desipramine 42 44 0 0 0 0 0 0 0 0999 V2000 2.3090 -1.0566 2.1839 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7478 -0.1807 1.1737 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7706 0.1053 0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3347 1.0154 -0.9133 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1653 0.4164 -1.7395 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0229 0.2253 -0.9972 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4672 -1.1329 -0.7963 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1668 -1.9038 -1.8959 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5172 -3.2344 -1.8727 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1588 -3.7338 -0.7387 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.9620 0.3575 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1073 -1.6107 0.3436 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5129 -0.9169 1.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3188 0.3067 1.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6899 1.3729 0.5334 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2217 2.6307 0.8614 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8328 3.7853 0.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8845 3.7061 -0.7628 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3318 2.4942 -1.1215 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7463 1.3706 -0.4672 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4138 -1.0122 2.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0278 -2.1161 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -0.8407 3.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 0.7010 1.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6019 0.6270 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1258 -0.8499 -0.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0388 1.9457 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2203 1.1294 -1.5725 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1177 0.8053 -2.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6469 -0.6165 -1.8931 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3121 -1.4172 -2.7339 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2819 -3.8314 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 -4.7710 -0.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9559 -3.3594 1.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1757 -1.6269 2.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6759 -0.6813 2.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2867 -0.0405 0.8749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6483 0.7646 2.3058 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9768 2.6836 1.6539 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2616 4.7640 0.5024 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5438 4.6071 -1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4153 2.4385 -1.9338 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 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 6 1 0 12 7 1 0 20 15 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 8 31 1 0 9 32 1 0 10 33 1 0 11 34 1 0 13 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 16 39 1 0 17 40 1 0 18 41 1 0 19 42 1 0 M END