Accuracy

9,10-dimethylphenanthrene    366 9,10-Dimethylphenanthrene

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    #  Species Formula
   356 1-MethyldiadamantaneC15H22
   357 3-MethyladamantaneC15H22
   358 4-MethyldiadamantaneC15H22
   359 6-(1,1-dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-IndeneC15H22
   360 n-NonylcyclohexaneC15H30
   361 PentadecaneC15H32
   362 FluorantheneC16H10
   363 PyreneC16H10
   364 2,7-DimethylphenanthreneC16H14
   365 4,5,9,10-TetrahydropyreneC16H14
   366 9,10-Dimethylphenanthrene C16H14
   367 (2.2)MetaparacyclophaneC16H16
   368 [2.2]MetacyclophaneC16H16
   369 [2.2]ParacyclophaneC16H16
   370 1,2,3,6,7,8-HexahydropyreneC16H18
   371 Tricyclo[8.2.2.2]-hexadecaneC16H28
   372 1-HexadeceneC16H32
   373 DecylcyclohexaneC16H32
   374 n-UndecylcyclopentaneC16H32
   375 n-DodecylcyclopentaneC17H34
   376 UndecylcyclohexaneC17H34


ΔHf: 40.0 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
9,10-Dimethylphenanthrene
 H=40 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.37861224 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.40477843 +1  119.8151186 +1    0.0000000 +0     2     1     0
  C     1.37872125 +1  119.9135700 +1   -0.2948546 +1     3     2     1
  C     1.41415174 +1  121.1727692 +1    0.2169730 +1     4     3     2
  C     1.41286991 +1  121.1255016 +1   -0.1172456 +1     1     2     3
  C     1.44708169 +1  121.3303530 +1 -179.0936835 +1     6     1     2
  C     1.40779618 +1  119.5326792 +1  179.9055787 +1     7     6     1
  C     1.44757670 +1  119.9331468 +1    0.6146705 +1     8     7     6
  C     1.36429520 +1  120.5256021 +1   -0.7232868 +1     9     8     7
  C     1.41415087 +1  118.8444358 +1 -179.9067982 +1     8     7     9
  C     1.37872363 +1  121.1526672 +1   -0.2209127 +1    11     8     7
  C     1.40471277 +1  119.9425700 +1   -0.0578608 +1    12    11     8
  C     1.41285365 +1  121.3327756 +1 -179.6976095 +1     7     6     8
  H     1.08984901 +1  119.3447796 +1 -179.8766793 +1     1     2     6
  H     1.08778034 +1  120.5394412 +1  179.9839321 +1     2     1     3
  H     1.08769044 +1  119.5710112 +1 -179.9312974 +1     3     2     4
  H     1.08869204 +1  119.1320322 +1  179.9157978 +1     4     3     5
  C     1.49465185 +1  116.9857449 +1  179.9640534 +1     9     8    10
  C     1.49477875 +1  122.4691619 +1  179.9886447 +1    10     9     8
  H     1.08862399 +1  119.7087055 +1  179.9254489 +1    11     8    12
  H     1.08778176 +1  120.5081176 +1  179.9315004 +1    12    11    13
  H     1.08767365 +1  119.6119728 +1 -179.9318634 +1    13    12    11
  H     1.08987223 +1  119.5542112 +1   -0.5042803 +1    14     7     6
  H     1.10050641 +1  111.0479589 +1   61.7309721 +1    19     9     8
  H     1.10041558 +1  111.1331804 +1 -120.3951093 +1    19     9    25
  H     1.09866354 +1  113.5410225 +1 -119.7630473 +1    19     9    26
  H     1.10053936 +1  111.0506695 +1  118.4477308 +1    20    10     9
  H     1.10045839 +1  111.1159894 +1  120.4087024 +1    20    10    28
  H     1.09863221 +1  113.5450152 +1  119.7620711 +1    20    10    29