HMDB0014650 RDKit 3D Triflupromazine 43 45 0 0 0 0 0 0 0 0999 V2000 4.0338 0.9076 -0.3822 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -0.2266 0.3186 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5595 -1.2135 0.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4252 -0.8941 -0.3618 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1092 -0.2538 -0.5051 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3482 0.0473 0.7714 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9422 0.5760 0.3024 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 1.9454 0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0853 2.8304 0.4015 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2357 4.2116 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4263 4.7113 -0.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4541 3.8370 -0.4948 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3008 2.4974 -0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7135 1.4740 -0.6933 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1908 -0.2049 -0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0852 -1.1950 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7662 -2.5178 -0.5283 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.8102 -0.0771 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0832 -4.2453 0.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8236 -5.0280 -0.7352 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7229 -4.4239 -0.0604 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4524 -4.5925 1.4213 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6221 -1.7895 0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9197 -0.4416 0.0429 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6716 1.4857 0.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3006 1.5393 -0.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7454 0.4644 -1.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1702 -2.1641 0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4415 -0.8098 0.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8442 -1.4496 -0.6098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8247 -1.1329 -1.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2883 -1.8940 0.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4792 -0.9003 -1.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1712 0.7299 -1.0514 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 0.8015 1.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2277 -0.8301 1.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8649 2.4567 0.7306 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6443 4.8126 0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5161 5.7931 -0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 4.2523 -0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1063 -0.9340 -1.0532 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4651 -3.3204 -0.7361 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6559 -2.1016 0.5372 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 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 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 19 21 1 0 19 22 1 0 18 23 1 0 23 24 2 0 24 7 1 0 13 8 1 0 24 15 1 0 1 25 1 0 1 26 1 0 1 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 6 36 1 0 9 37 1 0 10 38 1 0 11 39 1 0 12 40 1 0 16 41 1 0 17 42 1 0 23 43 1 0 M END