HMDB0041799 RDKit 3D 2,4-Toluenediamine 19 19 0 0 0 0 0 0 0 0999 V2000 -2.4527 -0.6543 -0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9661 -0.4413 -0.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0754 -1.4654 -0.3631 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2926 -1.3118 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.0522 0.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1607 0.1248 0.0646 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8976 1.0072 0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4676 0.8167 0.1993 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3998 1.8618 0.4492 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9094 0.1234 -0.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8508 -0.6616 0.8462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6054 -1.6455 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -2.4349 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -2.1459 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6898 -0.1687 0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6455 0.5542 -0.7384 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2731 1.9892 0.5081 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8455 1.9846 1.3782 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6396 2.5195 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 5 7 1 0 7 8 2 0 8 9 1 0 8 2 1 0 1 10 1 0 1 11 1 0 1 12 1 0 3 13 1 0 4 14 1 0 6 15 1 0 6 16 1 0 7 17 1 0 9 18 1 0 9 19 1 0 M END