HMDB0246023
     RDKit          3D
3,4-Diaminotoluene
 19 19  0  0  0  0  0  0  0  0999 V2000
    2.8970   -0.2628   -0.2247 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4296   -0.0287   -0.1343 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9894    1.2733   -0.0550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3473    1.6090    0.0325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2501    0.5711    0.0381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6283    0.9125    0.1282 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8266   -0.7532   -0.0412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8040   -1.7876   -0.0313 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5076   -1.0621   -0.1275 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2004    0.0213   -1.2503 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1568   -1.3099    0.0243 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3698    0.4677    0.4806 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6926    2.0943   -0.0589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6712    2.6395    0.0939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1887    0.9107   -0.7567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0323    1.1490    1.0493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5261   -2.7847    0.0583 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8200   -1.5751   -0.1132 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8512   -2.0843   -0.1896 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  1  0
  7  9  2  0
  9  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
  8 17  1  0
  8 18  1  0
  9 19  1  0
M  END