PM7 Accuracy

ethoxybenzene    823 Ethoxybenzene

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    #  Species Formula
   813 2,3-Dimethyl phenolC8H10O
   814 2,4-Dimethyl phenolC8H10O
   815 2,5-Dimethyl phenolC8H10O
   816 2,6-Dimethyl phenolC8H10O
   817 2-Ethyl phenolC8H10O
   818 3,4-Dimethyl phenolC8H10O
   819 3,5-Dimethyl phenolC8H10O
   820 3-Ethyl phenolC8H10O
   821 4-Ethyl phenolC8H10O
   822 Benzyl alcoholC8H10O
   823 Ethoxybenzene C8H10O
   824 PhenetoleC8H10O
   825 1-MethylnorcamphorC8H12O
   826 Bicyclo[2.2.2]octanoneC8H12O
   827 Bicyclo[3.2.1]octan-2-oneC8H12O
   828 Bicyclo[3.2.1]octan-3-oneC8H12O
   829 Bicyclo[3.2.1]octan-8-oneC8H12O
   830 cis-Bicyclo[3.3.0]-octan-2-oneC8H12O
   831 trans-Bicyclo[3.3.0]-octan-2-oneC8H12O
   832 3-Oxabicyclo[3,2,2]nonaneC8H14O
   833 6-Methyl-5-hepten-2-oneC8H14O


DHf: -24.3 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
Ethoxybenzene
 H=-24.3 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.39116338  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.39518890  1  120.7322456  1    0.0000000  0     2     1     0
  C     1.39470167  1  118.4324036  1    0.0245335  1     3     2     1
  C     1.40581844  1  121.6618092  1    0.0178917  1     4     3     2
  C     1.38661689  1  118.7022049  1   -0.0172659  1     5     4     3
  O     1.35607454  1  125.6370452  1 -179.9446743  1     4     3     5
  C     1.43215238  1  117.6279270  1   -0.0448384  1     7     4     3
  C     1.52196419  1  103.3557664  1 -179.9512444  1     8     7     4
  H     1.08601152  1  120.1537571  1  179.9930705  1     1     2     3
  H     1.08963286  1  119.8720791  1 -179.9964955  1     2     1     3
  H     1.08282447  1  119.8781643  1 -179.9959806  1     3     2     4
  H     1.08631418  1  119.6255588  1 -179.9995555  1     5     4     6
  H     1.08977458  1  119.7996015  1  179.9905146  1     6     5     4
  H     1.10409292  1  109.1329560  1  119.7556424  1     8     7     9
  H     1.10413885  1  109.1129937  1  120.5163171  1     8     7    15
  H     1.09847358  1  111.2121494  1  -60.2317396  1     9     8     7
  H     1.09862803  1  111.1679226  1  118.8511485  1     9     8    17
  H     1.09500187  1  111.2582584  1  120.5754670  1     9     8    18