PM7 Accuracy

hexanedinitrile    628 Hexanedinitrile

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    #  Species Formula
   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-CyanopyridineC6H4N2
   626 4-CyanopyridineC6H4N2
   627 2,3-Dimethyl pyrazineC6H8N2
   628 Hexanedinitrile C6H8N2
   629 PhenylhydrazineC6H8N2
   630 3(Dimethylamino) propanenitrileC6H12N2
   631 TetramethyldiazetineC6H12N2
   632 TriethylenediamineC6H12N2
   633 1,2-DiisopropyldiazeneC6H14N2
   634 DipropyldiazeneC6H14N2
   635 1H-BenzimidazoleC7H6N2
   636 1H-IndazoleC7H6N2
   637 1-Methyl-1-phenylhydrazineC7H10N2
   638 t-ButylmalononitrileC7H10N2


DHf: 35.7 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
Hexanedinitrile
 H=35.7 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.44442361  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.53817197  1  110.4758100  1    0.0000000  0     2     1     0
  C     1.53099923  1  110.2931332  1  179.9724603  1     3     2     1
  C     1.53842352  1  110.2989750  1  179.9873339  1     4     3     2
  C     1.44458713  1  110.4175012  1  179.8574976  1     5     4     3
  N     1.15658684  1  143.9437456  1 -179.9827685  1     6     4     5
  N     1.15656985  1  144.1065509  1 -179.9979146  1     1     3     2
  H     1.11722875  1  110.3871683  1 -122.1419856  1     2     1     3
  H     1.11731641  1  110.3821896  1 -115.7562979  1     2     1     9
  H     1.10839396  1  109.9234595  1  122.0252599  1     3     2     4
  H     1.10847425  1  109.9223000  1  115.9757756  1     3     2    11
  H     1.10833049  1  110.4431157  1 -121.7168662  1     4     3     5
  H     1.10845780  1  110.4337220  1 -116.5946459  1     4     3    13
  H     1.11704851  1  110.1503321  1  122.2089673  1     5     4     6
  H     1.11704213  1  110.1975275  1  115.6182414  1     5     4    15