PM7 Accuracy

2,7-dimethylphenanthrene    366 2,7-Dimethylphenanthrene

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    #  Species Formula
   356 TetradecaneC14H30
   357 4-MethylphenanthreneC15H12
   358 1-MethyldiadamantaneC15H22
   359 3-MethyladamantaneC15H22
   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-Dimethylphenanthrene C16H14
   367 4,5,9,10-TetrahydropyreneC16H14
   368 9,10-DimethylphenanthreneC16H14
   369 (2.2)MetaparacyclophaneC16H16
   370 [2.2]MetacyclophaneC16H16
   371 [2.2]ParacyclophaneC16H16
   372 1,2,3,6,7,8-HexahydropyreneC16H18
   373 Tricyclo[8.2.2.2]-hexadecaneC16H28
   374 1-HexadeceneC16H32
   375 DecylcyclohexaneC16H32
   376 n-UndecylcyclopentaneC16H32


DHf: 34.2 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
2,7-Dimethylphenanthrene
 H=34.2 HR=NIST
  C     0.01092976  1  -0.01191351  1  -0.00019044  1
  C     1.38785787  1   0.01680055  1  -0.00124831  1
  C     2.07669238  1   1.24841271  1  -0.02407459  1
  C     1.36028926  1   2.42821160  1  -0.04576465  1
  C    -0.05146872  1   2.41039919  1  -0.04491141  1
  C    -0.74242411  1   1.18377236  1  -0.02236774  1
  C    -2.18857652  1   1.18434495  1  -0.02196445  1
  C    -2.87872137  1   2.41141142  1  -0.04509573  1
  C    -2.14253129  1   3.64658897  1  -0.06779462  1
  C    -0.78679237  1   3.64610140  1  -0.06793478  1
  C    -4.29043257  1   2.43028314  1  -0.04554890  1
  C    -5.00751053  1   1.25094721  1  -0.02391325  1
  C    -4.31962466  1   0.01882493  1  -0.00055984  1
  C    -2.94271149  1  -0.01092565  1   0.00016434  1
  H    -0.50557353  1  -0.97113844  1   0.01753267  1
  H     1.95735787  1  -0.91035889  1   0.01576228  1
  C     3.56738746  1   1.24444748  1  -0.02510819  1
  H     1.87434040  1   3.38653350  1  -0.06350965  1
  H    -2.70851685  1   4.57697443  1  -0.08514511  1
  H    -0.22017595  1   4.57612628  1  -0.08507280  1
  H    -4.80390561  1   3.38891558  1  -0.06354340  1
  C    -6.49820313  1   1.24814998  1  -0.02445998  1
  H    -4.88987839  1  -0.90781647  1   0.01668757  1
  H    -2.42691719  1  -0.97051241  1   0.01832318  1
  H     3.99745669  1   2.25478933  1  -0.03850391  1
  H     3.96336494  1   0.71471209  1  -0.90396855  1
  H     3.96489338  1   0.73776411  1   0.86694675  1
  H    -6.92752213  1   2.25864288  1  -0.04644050  1
  H    -6.89574935  1   0.74941939  1   0.87187291  1
  H    -6.89499120  1   0.71130675  1  -0.89874883  1