PM7 Accuracy

benzylamine    522 Benzylamine

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    #  Species Formula
   512 CyclohexamethylenimineC6H13N
   513 CyclohexanamineC6H13N
   514 Di-n-propylamineC6H15N
   515 DiiospropylamineC6H15N
   516 TriethylamineC6H15N
   517 Trimethylborane-TrimethylamineH18BC6N
   518 Phenyl cyanideC7H5N
   519 1-CyclohexenecarbonitrileC7H9N
   520 2,6-DimethylpyridineC7H9N
   521 2-CyclohexenecarbonitrileC7H9N
   522 Benzylamine C7H9N
   523 m-ToluidineC7H9N
   524 N-MethylanilineC7H9N
   525 o-ToluidineC7H9N
   526 p-ToluidineC7H9N
   527 CyanocyclohexaneC7H11N
   528 CyclohexanecarbonitrileC7H11N
   529 Hexahydro-1H-pyrrolizineC7H13N
   530 n-HeptanenitrileC7H13N
   531 IsopropylbutylamineC7H17N
   532 1-NorbornylcyanideC8H11N


DHf: 21.0 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
Benzylamine
 H=20.98 HR=NIST
  C     0.00040616  1   0.00206634  1   0.00182880  1
  C    -1.09919730  1  -0.82106032  1  -0.24538656  1
  C    -1.00155640  1  -2.19529048  1  -0.03895220  1
  C     0.19388555  1  -2.75025528  1   0.41500631  1
  C     1.29272837  1  -1.92888736  1   0.66094341  1
  C     1.19703849  1  -0.55410677  1   0.45488247  1
  C    -0.11356732  1   1.49225900  1  -0.19943854  1
  N    -0.61424390  1   2.19743815  1   0.99835605  1
  H    -2.03286842  1  -0.39148813  1  -0.60267202  1
  H    -1.85909925  1  -2.83621358  1  -0.23383430  1
  H     0.26994101  1  -3.82436726  1   0.57475673  1
  H     2.22741018  1  -2.36161936  1   1.01302145  1
  H     2.05811319  1   0.08323431  1   0.64452134  1
  H     0.87041284  1   1.93722066  1  -0.47451641  1
  H    -0.79513417  1   1.72973057  1  -1.04899788  1
  H    -1.53356371  1   1.87687008  1   1.25861712  1
  H     0.00067106  1   2.06911188  1   1.78645043  1