PM7 Accuracy

2,3-dihydro-benzofuran    811 2,3-Dihydro-benzofuran

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    #  Species Formula
   801 2-Methyl cis-cyclohexanolC7H14O
   802 3,3-Dimethyl-2-pentanoneC7H14O
   803 4-HeptanoneC7H14O
   804 HeptanalC7H14O
   805 t-Butyl ethyl ketoneC7H14O
   806 n-HeptanolC7H16O
   807 t-Butyl isopropyl etherC7H16O
   808 BenzofuranC8H6O
   809 1,3-Dihydro isobenzofuranC8H8O
   810 1-PhenylethenolC8H8O
   811 2,3-Dihydro-benzofuran C8H8O
   812 AcetophenoneC8H8O
   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


DHf: -11.1 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
2,3-Dihydro-benzofuran
 H=-11.1 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.41042447  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.37813038  1  119.6258145  1    0.0000000  0     2     1     0
  C     1.40355745  1  118.3026512  1    0.0337520  1     3     2     1
  C     1.39254028  1  121.1613932  1   -0.0086304  1     4     3     2
  C     1.38325338  1  123.1340404  1   -0.0167323  1     1     2     3
  O     1.36377251  1  113.4269728  1  179.9849550  1     1     2     6
  C     1.45185892  1  107.7447315  1    0.0896510  1     7     1     2
  H     1.08660165  1  121.2764759  1 -179.9986720  1     3     2     4
  H     1.08721945  1  119.1474872  1 -179.9996182  1     4     3     5
  H     1.08995878  1  119.6489369  1  179.9965047  1     5     4     3
  H     1.08367980  1  121.7073758  1  179.9962306  1     6     1     2
  H     1.09961778  1  104.9852632  1 -121.6747129  1     8     7     1
  H     1.09967098  1  105.0038005  1 -116.9697560  1     8     7    13
  C     1.49483745  1  108.3929026  1 -179.9573763  1     2     1     3
  H     1.10421403  1  112.0577167  1  120.0410381  1    15     2     1
  H     1.10417513  1  112.0951184  1  119.6866876  1    15     2    16