HMDB0255863 RDKit 3D o-Phenetidine 21 21 0 0 0 0 0 0 0 0999 V2000 3.3436 0.6622 0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1843 -0.2992 0.1668 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9932 0.4433 0.1509 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2679 -0.1068 0.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5262 -1.4390 0.4193 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8156 -1.9097 0.5322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8914 -1.0549 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6584 0.2863 0.3504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3503 0.7590 0.2364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1472 2.1506 0.0842 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4783 1.2319 0.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1145 1.3004 -0.8682 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2787 0.1102 -0.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -0.8346 1.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2531 -1.0475 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2784 -2.1302 0.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0125 -2.9791 0.6512 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -1.4219 0.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 0.9762 0.3228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8498 2.7288 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3055 2.5740 -0.8465 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 4 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 5 16 1 0 6 17 1 0 7 18 1 0 8 19 1 0 10 20 1 0 10 21 1 0 M END