PM7 Accuracy

6,7-benzoquinoline    576 6,7-Benzoquinoline

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    #  Species Formula
   566 2,6-Dimethyl quinolineC11H11N
   567 2,7-Dimethyl quinolineC11H11N
   568 1-Adamantyl cyanideC11H15N
   569 1-Adamantyl isocyanideC11H15N
   570 2-Methyl-6-t-butylanilineC11H17N
   571 n-UndecanenitrileC11H21N
   572 CarbazoleC12H9N
   573 2-BiphenylamineC12H11N
   574 BiphenylamineC12H11N
   575 2-n-Butyl-2-methylhexanenitrileC12H23N
   576 6,7-Benzoquinoline C13H9N
   577 a-BenzoquinolineC13H9N
   578 AcridineC13H9N
   579 Benzo[f]quinolineC13H9N
   580 PhenanthridineC13H9N
   581 N-MethylcarbazoleC13H11N
   582 1,2,3,4-Tetrahydro-N-methylcarbazoleC13H15N
   583 9-Ethyl-9H-carbazoleC14H13N
   584 TetradecanenitrileC14H27N
   585 DioctylamineC16H35N
   586 TriphenylamineC18H15N


DHf: 58.2 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
6,7-Benzoquinoline
 H=58.2 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.38030131  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.40704852  1  120.5283851  1    0.0000000  0     2     1     0
  C     1.37973745  1  119.9582869  1   -0.0005317  1     3     2     1
  C     1.40776112  1  119.9894205  1   -0.0146870  1     4     3     2
  C     1.40777032  1  120.4205404  1   -0.0052529  1     5     4     3
  C     1.44577102  1  118.4074888  1 -179.9728921  1     6     5     4
  C     1.41369297  1  118.1728545  1   -0.0074384  1     7     6     5
  N     1.39368010  1  122.3108147  1    0.0074941  1     8     7     6
  C     1.30311243  1  119.1773167  1    0.0103558  1     9     8     7
  C     1.41482724  1  120.5081415  1  179.9944440  1     8     7     9
  C     1.37770952  1  119.6124588  1   -0.0030930  1    11     8     7
  C     1.40772595  1  120.2495381  1   -0.0021896  1    12    11     8
  C     1.38013529  1  120.5802233  1    0.0003361  1    13    12    11
  H     1.08921016  1  119.9515183  1 -179.9962005  1     1     2     3
  H     1.08976864  1  120.2278189  1  179.9983515  1     2     1     3
  H     1.08837679  1  119.4335618  1  179.9976041  1     3     2     4
  H     1.08950477  1  120.6175042  1 -179.9998453  1     4     3     5
  H     1.09888602  1  117.3102544  1 -179.9982870  1    10     9     8
  H     1.08907888  1  120.4125007  1 -179.9981257  1    12    11    13
  H     1.08899458  1  119.1906871  1  179.9995431  1    13    12    14
  H     1.08947431  1  119.8629690  1  179.9976212  1    14    13    12
  H     1.09094137  1  118.5879439  1 -179.9978243  1    11     8    12