PM7 Accuracy

o-toluidine    525 o-Toluidine

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    #  Species Formula
   515 DiiospropylamineC6H15N
   516 TriethylamineC6H15N
   517 Trimethylborane-TrimethylamineH18BC6N
   518 Phenyl cyanideC7H5N
   519 1-CyclohexenecarbonitrileC7H9N
   520 2,6-DimethylpyridineC7H9N
   521 2-CyclohexenecarbonitrileC7H9N
   522 BenzylamineC7H9N
   523 m-ToluidineC7H9N
   524 N-MethylanilineC7H9N
   525 o-Toluidine C7H9N
   526 p-ToluidineC7H9N
   527 CyanocyclohexaneC7H11N
   528 CyclohexanecarbonitrileC7H11N
   529 Hexahydro-1H-pyrrolizineC7H13N
   530 n-HeptanenitrileC7H13N
   531 IsopropylbutylamineC7H17N
   532 1-NorbornylcyanideC8H11N
   533 1-NorbornylisocyanideC8H11N
   534 5-Ethyl-2-methyl-pyridineC8H11N
   535 N,N-Dimethyl anilineC8H11N


DHf: 12.7 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
o-Toluidine
 H=12.7 HR=NIST S=83.89 CP=31.11
  C    -0.02128861  1   0.00273958  1  -0.01952044  1
  C    -0.08864217  1  -1.48696340  1  -0.02916618  1
  C    -0.72841546  1  -2.16257845  1   1.00565422  1
  C    -0.81684421  1  -3.55436158  1   1.01183117  1
  C    -0.26445859  1  -4.28713442  1  -0.03532316  1
  C     0.38545294  1  -3.63924668  1  -1.07932107  1
  C     0.48336284  1  -2.23677476  1  -1.08156553  1
  N     1.09134419  1  -1.60100321  1  -2.17163123  1
  H     1.01024638  1   0.36181066  1   0.10091355  1
  H    -0.42560622  1   0.42934015  1  -0.95012036  1
  H    -0.60684444  1   0.44013783  1   0.80180097  1
  H    -1.16639636  1  -1.59653532  1   1.82688497  1
  H    -1.31559720  1  -4.06305019  1   1.83095713  1
  H    -0.33665271  1  -5.37358288  1  -0.03701452  1
  H     0.80993867  1  -4.21486288  1  -1.89573999  1
  H     1.42178307  1  -0.66689347  1  -2.04288475  1
  H     1.67102354  1  -2.15971843  1  -2.76525749  1