PM7 Accuracy

nonadecane    395 Nonadecane

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    #  Species Formula
   385 DodecylcyclohexaneC18H36
   386 n-TridecylcyclopentaneC18H36
   387 1,1,2,2-Tetra-t-butylethaneC18H38
   388 OctadecaneC18H38
   389 TriphenylboraneH15BC18
   390 TricyclohexylboraneH33BC18
   391 Tri-n-hexylboraneH39BC18
   392 2,6-Diphenyl-1,6-heptadieneC19H20
   393 n-TetradecylcyclopentaneC19H38
   394 n-TridecylcyclohexaneC19H38
   395 Nonadecane C19H40
   396 9,10-Dihydro-9,10[1',2']benzanthraceneC20H14
   397 3,9-Dimethylbenz[a]anthraceneC20H16
   398 5,6-Dimethyl chryseneC20H16
   399 9,10-Dimethyl-1,2-benzanthraceneC20H16
   400 1,3,5-Tri-tert-butyl pentaleneC20H30
   401 HexacyclopropylethaneC20H30
   402 Tetra-tert-butyltetrahedraneC20H36
   403 Meso-3,4-dicyclohexyl-2,5-dimethylhexaneC20H38
   404 TetradecylcyclohexaneC20H40
   405 EicosaneC20H42


DHf: -104.0 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
Nonadecane
 H=-104.00 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.52878701  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.53455751  1  110.9081272  1    0.0000000  0     2     1     0
  C     1.53387562  1  110.7626883  1  179.9570773  1     3     2     1
  C     1.53398454  1  110.7105834  1 -179.9706388  1     4     3     2
  C     1.53401569  1  110.6789775  1  179.9307056  1     5     4     3
  C     1.53396376  1  110.6999580  1 -179.9852825  1     6     5     4
  C     1.53395368  1  110.6819613  1  179.9271699  1     7     6     5
  C     1.53396644  1  110.7032934  1 -179.9862200  1     8     7     6
  C     1.53395740  1  110.6847367  1  179.9294339  1     9     8     7
  C     1.53396231  1  110.7017695  1 -179.9880736  1    10     9     8
  C     1.53395943  1  110.6867307  1  179.9314328  1    11    10     9
  C     1.53396097  1  110.6993900  1 -179.9948564  1    12    11    10
  C     1.53395947  1  110.6869354  1  179.9345141  1    13    12    11
  C     1.53402116  1  110.6934512  1  179.9985020  1    14    13    12
  C     1.53398225  1  110.6865425  1  179.9376890  1    15    14    13
  C     1.53387401  1  110.7017926  1  179.9917423  1    16    15    14
  C     1.53458434  1  110.7723706  1  179.9368752  1    17    16    15
  C     1.52881543  1  110.8971752  1  179.9869499  1    18    17    16
  H     1.09544227  1  111.2474235  1 -179.9668186  1     1     2     3
  H     1.09564058  1  111.4301778  1   60.0867192  1     1     2     3
  H     1.09565082  1  111.4398546  1  -60.0085699  1     1     2     3
  H     1.10630193  1  109.9603605  1   58.1536325  1     2     1    20
  H     1.10630667  1  109.9696335  1  -58.0784291  1     2     1    20
  H     1.10580749  1  109.9496933  1   58.0703728  1     3     2     1
  H     1.10571492  1  109.9729019  1  -58.1307835  1     3     2     1
  H     1.10588248  1  110.0120841  1   58.2171515  1     4     3     2
  H     1.10586675  1  110.0315063  1  -58.1291538  1     4     3     2
  H     1.10591991  1  110.0095193  1   58.1139689  1     5     4     3
  H     1.10583687  1  110.0285617  1  -58.2285992  1     5     4     3
  H     1.10589747  1  110.0096499  1   58.2021464  1     6     5     4
  H     1.10588677  1  110.0271161  1  -58.1431876  1     6     5     4
  H     1.10592415  1  110.0195017  1   58.1154347  1     7     6     5
  H     1.10584602  1  110.0368851  1  -58.2365025  1     7     6     5
  H     1.10589599  1  110.0162460  1   58.2003206  1     8     7     6
  H     1.10589041  1  110.0316496  1  -58.1438700  1     8     7     6
  H     1.10591918  1  110.0204042  1   58.1180202  1     9     8     7
  H     1.10584951  1  110.0351059  1  -58.2346141  1     9     8     7
  H     1.10589287  1  110.0168306  1   58.1980005  1    10     9     8
  H     1.10589090  1  110.0301585  1  -58.1453891  1    10     9     8
  H     1.10591544  1  110.0219651  1   58.1184010  1    11    10     9
  H     1.10585810  1  110.0324409  1  -58.2339721  1    11    10     9
  H     1.10588994  1  110.0179544  1   58.1914122  1    12    11    10
  H     1.10589041  1  110.0294853  1  -58.1521977  1    12    11    10
  H     1.10591005  1  110.0253537  1   58.1185203  1    13    12    11
  H     1.10586824  1  110.0303930  1  -58.2334913  1    13    12    11
  H     1.10588389  1  110.0238118  1   58.1900853  1    14    13    12
  H     1.10588856  1  110.0332528  1  -58.1666998  1    14    13    12
  H     1.10589843  1  110.0369640  1   58.1245400  1    15    14    13
  H     1.10586993  1  110.0375059  1  -58.2405639  1    15    14    13
  H     1.10586264  1  110.0178895  1   58.1743282  1    16    15    14
  H     1.10587321  1  110.0236798  1  -58.1694756  1    16    15    14
  H     1.10577685  1  110.0830186  1   58.1075547  1    17    16    15
  H     1.10576295  1  110.0780645  1  -58.2346490  1    17    16    15
  H     1.10628994  1  109.9870681  1   58.1251282  1    18    17    16
  H     1.10629906  1  109.9916638  1  -58.1356710  1    18    17    16
  H     1.09545475  1  111.2549494  1  179.9311687  1    19    18    17
  H     1.09565739  1  111.4340380  1   59.9708778  1    19    18    17
  H     1.09564785  1  111.4246049  1  -60.1185259  1    19    18    17