PM7 Accuracy

3-cyanopyridine    625 3-Cyanopyridine

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    #  Species Formula
   615 2-AminopyridineC5H6N2
   616 3-AminopyridineC5H6N2
   617 4-AminopyridineC5H6N2
   618 Dimethyl propanedinitrileC5H6N2
   619 2-Ethyl-1H-imidazoleC5H8N2
   620 DiethylcyanamideC5H10N2
   621 ButylmethyldiazeneC5H12N2
   622 ButylmethyldiazineC5H12N2
   623 N,N-Dimethyl-1,3-propanediamineC5H14N2
   624 2-CyanopyridineC6H4N2
   625 3-Cyanopyridine C6H4N2
   626 4-CyanopyridineC6H4N2
   627 2,3-Dimethyl pyrazineC6H8N2
   628 HexanedinitrileC6H8N2
   629 PhenylhydrazineC6H8N2
   630 3(Dimethylamino) propanenitrileC6H12N2
   631 TetramethyldiazetineC6H12N2
   632 TriethylenediamineC6H12N2
   633 1,2-DiisopropyldiazeneC6H14N2
   634 DipropyldiazeneC6H14N2
   635 1H-BenzimidazoleC7H6N2


DHf: 66.4 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
3-Cyanopyridine
 H=66.42 HR=NIST
  N     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.34673773  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.40265811  1  122.6304590  1    0.0000000  0     2     1     0
  C     1.39105242  1  118.7003079  1   -0.0327726  1     3     2     1
  C     1.40015761  1  118.8851405  1    0.0050279  1     4     3     2
  C     1.34240296  1  118.8868594  1    0.0073104  1     1     2     3
  C     1.41600037  1  120.8266575  1 -179.9854433  1     5     4     3
  N     1.15741584  1  150.6092275  1  179.9945008  1     7     4     5
  H     1.09793990  1  115.6104700  1 -179.9968410  1     2     1     3
  H     1.08762529  1  120.3981783  1  179.9956891  1     3     2     4
  H     1.09191964  1  120.8198223  1 -179.9983322  1     4     3     5
  H     1.09859430  1  116.2524562  1 -179.9873639  1     6     1     2