PM7 Accuracy

3-methyladamantane    359 3-Methyladamantane

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    #  Species Formula
   349 1,3,5,7-TetramethyladamantaneC14H24
   350 (E)-3,4-Di-tert-butyl-3-hexeneC14H28
   351 CyclotetradecaneC14H28
   352 n-NonylcyclopentaneC14H28
   353 OctylcyclohexaneC14H28
   354 3,3,4,4-TetraethylhexaneC14H30
   355 OctamethylhexaneC14H30
   356 TetradecaneC14H30
   357 4-MethylphenanthreneC15H12
   358 1-MethyldiadamantaneC15H22
   359 3-Methyladamantane C15H22
   360 4-MethyldiadamantaneC15H22
   361 6-(1,1-dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-IndeneC15H22
   362 n-NonylcyclohexaneC15H30
   363 PentadecaneC15H32
   364 FluorantheneC16H10
   365 PyreneC16H10
   366 2,7-DimethylphenanthreneC16H14
   367 4,5,9,10-TetrahydropyreneC16H14
   368 9,10-DimethylphenanthreneC16H14
   369 (2.2)MetaparacyclophaneC16H16


DHf: -37.6 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
3-Methyladamantane
 H=-37.60 HR=NIST
  C    -0.00377701  1  -0.00548593  1   0.01104955  1
  C     1.53986149  1  -0.04300970  1   0.04560741  1
  C     2.08404429  1   1.40298203  1   0.01203854  1
  C     1.62031988  1   2.08676345  1  -1.29372150  1
  C     0.07518493  1   2.12562036  1  -1.32438229  1
  C    -0.46976313  1   0.67719701  1  -1.29336147  1
  H    -0.39921887  1  -1.04412697  1   0.04731072  1
  C    -0.53062589  1   0.78026245  1   1.22509444  1
  C     2.06380079  1  -0.82277202  1  -1.17152826  1
  H     1.87686050  1  -0.54223975  1   0.98001820  1
  H     3.19509758  1   1.37999922  1   0.04257969  1
  C     1.55338686  1   2.18522143  1   1.22575452  1
  H     2.01505855  1   3.12554071  1  -1.32677833  1
  C     2.14943907  1   1.29809868  1  -2.50447119  1
  H    -0.26259363  1   2.62704820  1  -2.25781230  1
  C    -0.44953979  1   2.90664770  1  -0.10833563  1
  H    -1.58062013  1   0.69973755  1  -1.31784691  1
  C     0.05457756  1  -0.07083931  1  -2.53804255  1
  C     0.01468052  1   2.21930904  1   1.18883073  1
  H    -1.63437947  1   0.79021646  1   1.22122779  1
  H    -0.22824832  1   0.28065932  1   2.16113482  1
  C     1.59696333  1  -0.14087889  1  -2.46900703  1
  H     1.70894346  1  -1.86721605  1  -1.13735147  1
  H     3.16663449  1  -0.87263557  1  -1.14555204  1
  H     1.95799851  1   3.21210755  1   1.22336082  1
  H     1.90247650  1   1.71708343  1   2.16247350  1
  H     1.85741822  1   1.79853331  1  -3.44351790  1
  H     3.25309403  1   1.28196275  1  -2.49446709  1
  H    -0.08656999  1   3.94843681  1  -0.13924465  1
  H    -1.55171033  1   2.96108331  1  -0.13774450  1
  H    -0.22439611  1   0.52531331  1  -3.44267753  1
  C    -0.57880668  1  -1.45622804  1  -2.68312184  1
  H    -0.36644896  1   2.78468473  1   2.06725672  1
  H     1.98016400  1  -0.70982231  1  -3.34457644  1
  H    -0.22353122  1  -1.95873101  1  -3.58929099  1
  H    -0.34263817  1  -2.10594354  1  -1.83368905  1
  H    -1.67012277  1  -1.38524630  1  -2.74728595  1