PM7 Accuracy

   396 9,10-Dihydro-9,10[1',2']benzanthracene

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    #  Species Formula
   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 NonadecaneC19H40
   396 9,10-Dihydro-9,10[1',2']benzanthracene C20H14
   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
   406 1,8-ParacyclophaneC21H26



DHf: 76.9 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.

  

9,10-Dihydro-9,10[1',2']benzanthracene
 H=76.9 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0                     0.0000
  C     1.52656461  1    0.0000000  0    0.0000000  0     1     0     0   0.0000
  C     1.52647494  1  105.2482538  1    0.0000000  0     1     2     0   0.0000
  C     1.52645555  1  105.2649399  1  110.9373111  1     1     2     3   0.0000
  C     1.42444867  1  113.3846616  1  -55.4954632  1     2     1     3   0.0000
  C     1.38520048  1  126.0577243  1  124.5112201  1     2     1     3   0.0000
  C     1.42464520  1  113.4162293  1   55.5174993  1     3     1     2   0.0000
  C     1.38511144  1  126.0464158  1 -124.5290827  1     3     1     2   0.0000
  C     1.42444647  1  113.4528550  1  -55.4818914  1     4     1     2   0.0000
  C     1.38513662  1  126.0237362  1  124.4887097  1     4     1     2   0.0000
  C     1.52665422  1  113.4042193  1    0.0411888  1     5     2     1   0.0000
  C     1.38516417  1  120.5415444  1 -179.9732756  1     5     2     1   0.0000
  C     1.40860373  1  118.7184049  1  179.9814116  1     6     2     1   0.0000
  C     1.38510643  1  120.5259804  1  179.9299570  1     7     3     1   0.0000
  C     1.40866714  1  118.7211347  1 -179.9303809  1     8     3     1   0.0000
  C     1.38517016  1  120.5340889  1  179.9993688  1     9     4     1   0.0000
  C     1.40856453  1  118.7172793  1 -179.9862131  1    10     4     1   0.0000
  C     1.40860487  1  118.7240326  1   -0.0034552  1    12     5     2   0.0000
  C     1.40868321  1  118.7256612  1    0.0032420  1    14     7     3   0.0000
  C     1.40857810  1  118.7201262  1   -0.0196263  1    16     9     4   0.0000
  H     1.10364289  1  113.4179524  1  179.9532080  1     1     2     5   0.0000
  H     1.08583793  1  121.2116213  1    0.0165706  1     6     2     1   0.0000
  H     1.08584522  1  121.2071966  1    0.0252664  1     8     3     1   0.0000
  H     1.08584900  1  121.2183639  1    0.0232111  1    10     4     1   0.0000
  H     1.10387638  1  113.4133368  1  179.9695531  1    11     5     2   0.0000
  H     1.08588269  1  121.2104700  1  179.9736582  1    12     5     2   0.0000
  H     1.08767465  1  119.2093460  1 -179.9841194  1    13     6     2   0.0000
  H     1.08588342  1  121.2075891  1 -179.9691464  1    14     7     3   0.0000
  H     1.08767195  1  119.2113019  1  179.9709042  1    15     8     3   0.0000
  H     1.08588284  1  121.2154107  1  179.9868485  1    16     9     4   0.0000
  H     1.08763133  1  119.2090924  1 -179.9903404  1    17    10     4   0.0000
  H     1.08765908  1  119.2069528  1  179.9856308  1    18    12     5   0.0000
  H     1.08765210  1  119.2086360  1 -179.9706268  1    19    14     7   0.0000
  H     1.08763223  1  119.2117347  1  179.9974229  1    20    16     9   0.0000