PM7 Accuracy

8-quinolinol    988 8-Quinolinol

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    #  Species Formula
   978 1,3-dimethyl-2-nitroso-benzeneC8H9NO
   979 N-methyl-N-phenyl formamideC8H9NO
   980 Octanone-1-oximeC8H17NO
   981 Octanone-2-oximeC8H17NO
   982 Octanone-3-oximeC8H17NO
   983 Octanone-4-oximeC8H17NO
   984 2(1H)-QuinolinoneC9H7NO
   985 3-Phenyl isoxazoleC9H7NO
   986 4-QuinolinolC9H7NO
   987 5-Phenyl isoxazoleC9H7NO
   988 8-Quinolinol C9H7NO
   989 a-CyanoacetophenoneC9H7NO
   990 2,4,6-TrimethylnitrosobenzeneC9H11NO
   991 N,N-Dimethyl benzamideC9H11NO
   992 N,N-Dimethyamino-2,4,6-heptatriene-7-alC9H13NO
   993 2,2,6,6-Tetramethyl-4-piperidinoneC9H17NO
   994 2-Methyl-4-hydroxyquinolineC10H9NO
   995 2-Methyl-8-quinolinolC10H9NO
   996 3-Methyl-5-phenyl isoxazoleC10H9NO
   997 4-Methyl-2-hydroxyquinolineC10H9NO
   998 5-Methyl-3-phenyl isoxazoleC10H9NO


DHf: 1.6 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
8-Quinolinol
 H=1.6 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.37421314  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.41632071  1  117.6106782  1    0.0000000  0     2     1     0
  C     1.37879709  1  122.5847685  1    0.0527000  1     3     2     1
  C     1.41763023  1  120.3425815  1    0.0263695  1     4     3     2
  C     1.40530907  1  117.4407267  1   -0.0312122  1     5     4     3
  N     1.36728901  1  126.0695652  1  179.9413949  1     6     5     4
  C     1.32398164  1  116.5588494  1   -0.0165091  1     7     6     5
  C     1.43136164  1  122.3825167  1    0.0126459  1     8     7     6
  C     1.37268643  1  120.1749168  1    0.0027631  1     9     8     7
  O     1.33639809  1  124.1961468  1  179.9860279  1     1     2     3
  H     1.08514601  1  121.4841894  1 -179.9918639  1     2     1     3
  H     1.09221232  1  117.7624262  1 -179.9968261  1     3     2     4
  H     1.08653133  1  120.7088071  1 -179.9983583  1     4     3     5
  H     1.09593783  1  117.2829919  1 -179.9950989  1     8     7     9
  H     1.08763862  1  118.5739743  1 -179.9995309  1     9     8    10
  H     1.08909587  1  121.5933596  1  179.9992763  1    10     9     8
  H     1.00635457  1  113.5882309  1  179.9834231  1    11     1     2