PM7 Accuracy

tetradecylcyclohexane    404 Tetradecylcyclohexane

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    #  Species Formula
   394 n-TridecylcyclohexaneC19H38
   395 NonadecaneC19H40
   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 Tetradecylcyclohexane C20H40
   405 EicosaneC20H42
   406 1,8-ParacyclophaneC21H26
   407 HexadecylcyclopentaneC21H42
   408 PentadecylcyclohexaneC21H42
   409 Tri-n-heptylboraneH45BC21
   410 1,1'-Diphenyl-1,1'-bicyclopentylC22H26
   411 DL-3,4-di-1-cyclohexen-1-yl-2,2,5,5-tetramethyl hexaneC22H38
   412 Meso-3,4-di-1-cyclohexen-1-yl-2,2,5,5-tetramethyl hexaneC22H38
   413 n-HexadecylcyclohexaneC22H44
   414 p-QuaterphenylC24H18


DHf: -100.2 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.
  
 INT PM7
Tetradecylcyclohexane
 H=-100.21 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.53408069  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.53455886  1  110.6604152  1    0.0000000  0     2     1     0
  C     1.53452028  1  110.5446450  1  -56.8177614  1     3     2     1
  C     1.53398292  1  110.7037708  1   56.6028404  1     4     3     2
  C     1.53901028  1  110.5348600  1  -57.7076167  1     5     4     3
  C     1.53908755  1  110.9480785  1  179.6433594  1     6     5     4
  C     1.53347707  1  111.5816266  1   74.3340998  1     7     6     5
  C     1.53410834  1  110.6212661  1 -178.9473712  1     8     7     6
  C     1.53373204  1  110.6272028  1 -178.6418665  1     9     8     7
  C     1.53374673  1  110.7100747  1 -179.7703594  1    10     9     8
  C     1.53373329  1  110.6886835  1 -179.4439501  1    11    10     9
  C     1.53380321  1  110.7062031  1  179.9735427  1    12    11    10
  C     1.53374213  1  110.6856891  1 -179.6844518  1    13    12    11
  C     1.53379467  1  110.6991898  1  179.8962316  1    14    13    12
  C     1.53381248  1  110.6813654  1 -179.8238523  1    15    14    13
  C     1.53382117  1  110.6949019  1  179.9072163  1    16    15    14
  C     1.53369439  1  110.6922028  1 -179.9374756  1    17    16    15
  C     1.53428753  1  110.7731938  1  179.9190700  1    18    17    16
  C     1.52877800  1  110.9047059  1 -179.9957752  1    19    18    17
  H     1.10452663  1  109.9706548  1  179.8516296  1     1     2     3
  H     1.10515051  1  109.9888150  1  -63.4781587  1     1     2     3
  H     1.10593687  1  109.8906318  1 -121.5568212  1     2     1     3
  H     1.10484664  1  110.0900454  1  121.9489935  1     2     1     3
  H     1.10462827  1  110.1190014  1 -178.7161104  1     3     2     1
  H     1.10570117  1  109.8731388  1   64.6668736  1     3     2     1
  H     1.10574679  1  109.9424452  1  -65.1119071  1     4     3     2
  H     1.10505229  1  110.0326492  1  178.3863158  1     4     3     2
  H     1.10489066  1  109.9665852  1 -179.6126992  1     5     4     3
  H     1.10523236  1  110.0085071  1   63.9499302  1     5     4     3
  H     1.11526233  1  108.9169855  1  -60.2608807  1     6     5     4
  H     1.10544018  1  110.0499629  1  -48.3220564  1     7     6     5
  H     1.10669770  1  109.7196368  1 -164.2082990  1     7     6     5
  H     1.10612225  1  110.0004403  1   59.2642984  1     8     7     6
  H     1.10590092  1  110.3036951  1  -57.1150238  1     8     7     6
  H     1.10595984  1  110.0299607  1   59.5552907  1     9     8     7
  H     1.10582750  1  110.0857120  1  -56.8094632  1     9     8     7
  H     1.10599730  1  110.0523326  1   58.4160334  1    10     9     8
  H     1.10598004  1  110.0655461  1  -57.9121698  1    10     9     8
  H     1.10594909  1  110.0676220  1   58.7091837  1    11    10     9
  H     1.10596264  1  110.0533696  1  -57.6210329  1    11    10     9
  H     1.10599416  1  110.0536810  1   58.1537091  1    12    11    10
  H     1.10596525  1  110.0593361  1  -58.1702526  1    12    11    10
  H     1.10595909  1  110.0646759  1   58.4680721  1    13    12    11
  H     1.10598961  1  110.0443989  1  -57.8626142  1    13    12    11
  H     1.10598582  1  110.0576140  1   58.0729083  1    14    13    12
  H     1.10597867  1  110.0577987  1  -58.2525680  1    14    13    12
  H     1.10596901  1  110.0684628  1   58.3370812  1    15    14    13
  H     1.10598608  1  110.0509740  1  -58.0083647  1    15    14    13
  H     1.10597564  1  110.0683825  1   58.0869103  1    16    15    14
  H     1.10597469  1  110.0673504  1  -58.2526822  1    16    15    14
  H     1.10595675  1  110.0603586  1   58.2182806  1    17    16    15
  H     1.10596066  1  110.0451781  1  -58.1157644  1    17    16    15
  H     1.10586080  1  110.1112303  1   58.0785264  1    18    17    16
  H     1.10587080  1  110.1086441  1  -58.2323980  1    18    17    16
  H     1.10638153  1  110.0287471  1   58.1210121  1    19    18    17
  H     1.10637414  1  110.0205043  1  -58.1264962  1    19    18    17
  H     1.09536007  1  111.2861441  1 -179.9990965  1    20    19    18
  H     1.09565434  1  111.4261591  1   60.0369444  1    20    19    18
  H     1.09567360  1  111.4287330  1  -60.0279863  1    20    19    18