PM7 Accuracy

Butylmethyldiazine    622 Butylmethyldiazine

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    #  Species Formula
   612 (Dimethylamino) acetonitrileC4H8N2
   613 1,4,5,6-TetrahydropyrimidineC4H8N2
   614 PiperazineC4H10N2
   615 2-AminopyridineC5H6N2
   616 3-AminopyridineC5H6N2
   617 4-AminopyridineC5H6N2
   618 Dimethyl propanedinitrileC5H6N2
   619 2-Ethyl-1H-imidazoleC5H8N2
   620 DiethylcyanamideC5H10N2
   621 ButylmethyldiazeneC5H12N2
   622 Butylmethyldiazine C5H12N2
   623 N,N-Dimethyl-1,3-propanediamineC5H14N2
   624 2-CyanopyridineC6H4N2
   625 3-CyanopyridineC6H4N2
   626 4-CyanopyridineC6H4N2
   627 2,3-Dimethyl pyrazineC6H8N2
   628 HexanedinitrileC6H8N2
   629 PhenylhydrazineC6H8N2
   630 3(Dimethylamino) propanenitrileC6H12N2
   631 TetramethyldiazetineC6H12N2
   632 TriethylenediamineC6H12N2


DHf: 18.9 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
Butylmethyldiazine
 H=18.9 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.52848542  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.53218224  1  110.6413144  1    0.0000000  0     2     1     0
  C     1.53758164  1  110.3019663  1  179.9516293  1     3     2     1
  N     1.47462336  1  106.9389386  1 -179.9762202  1     4     3     2
  N     1.24451146  1  115.5804843  1 -179.9585011  1     5     4     3
  C     1.46794573  1  115.4573717  1  179.9913504  1     6     5     4
  H     1.09614277  1  111.4658269  1  -59.8542083  1     1     2     3
  H     1.09607590  1  111.4697949  1  120.0600240  1     1     2     8
  H     1.09561422  1  111.2687966  1  119.9790020  1     1     2     9
  H     1.10654680  1  109.9010577  1 -121.8888622  1     2     1     3
  H     1.10669217  1  109.8778079  1 -116.2393748  1     2     1    11
  H     1.10655914  1  110.6528917  1  121.9409048  1     3     2     4
  H     1.10694942  1  110.5941706  1  116.1968927  1     3     2    13
  H     1.11208993  1  110.7410309  1  121.2750299  1     4     3     5
  H     1.11222033  1  110.7481224  1  117.4514273  1     4     3    15
  H     1.10308885  1  112.6905150  1  -59.9312583  1     7     6     5
  H     1.10285703  1  112.6351756  1  121.5953119  1     7     6    17
  H     1.10476964  1  106.8616039  1  119.2521013  1     7     6    18