HMDB0002182 RDKit 3D Phenylephrine 25 25 0 0 0 0 0 0 0 0999 V2000 -4.0082 -0.2151 -0.1762 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8258 0.0885 -0.9627 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6705 -0.0712 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3865 0.2224 -0.8245 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1978 -0.6242 -1.9161 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8007 0.1385 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7929 0.0200 1.3808 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9719 -0.0508 2.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2091 -0.0037 1.4252 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2321 0.1149 0.0665 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4478 0.1667 -0.6395 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0443 0.1847 -0.6195 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3288 0.7417 0.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8251 -0.9926 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8397 -0.5224 -0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 1.0497 -1.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7909 0.6625 0.7228 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7205 -1.0652 0.3374 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4326 1.2535 -1.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5882 -0.2704 -2.7482 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1358 -0.0190 1.9142 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0185 -0.1452 3.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1468 -0.0577 1.9551 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9251 1.0210 -0.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0982 0.2786 -1.6978 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 10 12 2 0 12 6 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 6 5 20 1 0 7 21 1 0 8 22 1 0 9 23 1 0 11 24 1 0 12 25 1 0 M END