PM7 Accuracy

1,1-diphenyl-1,1-bicyclooctyl    427 1,1-Diphenyl-1,1-bicyclooctyl

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    #  Species Formula
   417 Tri-n-octylboraneH51BC24
   418 TetraphenylmethaneC25H20
   419 9,9'-Bi-9H-fluoreneC26H18
   420 1,1,1,2-TetraphenylethaneC26H22
   421 1,1,2,2-TetraphenylethaneC26H22
   422 Pentacyclo hexacosa nonaneC26H26
   423 2,3-Dimethyl-2,3-bis(4-t-butylphenyl)butaneC26H38
   424 11-n-butyl docosaneC26H54
   425 5-n-butyl docosaneC26H54
   426 9,9'-Dimethyl-9,9'-bifluoreneC28H22
   427 1,1-Diphenyl-1,1-bicyclooctyl C28H38
   428 11-Decyl heneicosaneC31H64
   429 2,4,5,7-Tetramethyl-4,5-bis(4-t-butylphenyl) octaneC32H50
   430 DotriacontaneC32H66
   431 4,5-Dipropyl-4,5-bis(4-t-butylphenyl) octaneC34H54
   432 5,6-Dibutyl-5,6-bis(4-t-butylphenyl) decaneC38H62
   433 5,6-Dibutyl-5,6-bis(4-tert-butylphenyl)decaneC38H62
   434 Nitrogen, cationN
   435 Nitrogen, atomN
   436 AmidogenH2N
   437 AmmoniaH3N


DHf: 16.6 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
1,1-Diphenyl-1,1-bicyclooctyl
 H=16.6 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.39120002  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.39312249  1  120.2505859  1    0.0000000  0     2     1     0
  C     1.39228160  1  119.1014496  1    0.2659719  1     1     2     3
  C     1.39238029  1  120.3724105  1   -0.2188132  1     4     1     2
  C     1.39910374  1  121.5434263  1   -0.0495592  1     3     2     1
  C     1.54422267  1  121.3493917  1  178.9316386  1     6     3     2
  C     2.58115952  1  138.0927330  1  -98.5541811  1     7     6     3
  C     1.39996936  1  120.9698110  1  124.7377486  1     8     7     6
  C     1.39299022  1  121.2304532  1  139.3019014  1     9     8     7
  C     1.40163609  1  110.2595996  1  -92.1969313  1     8     7     6
  C     1.51725807  1   35.2347321  1   22.2941644  1     8     7     6
  C     1.39197012  1  121.2488446  1 -143.2047724  1    11     8     7
  C     1.39163256  1  120.2887504  1    0.3602372  1    10     9     8
  C     1.55667700  1  106.4640321  1  153.1252108  1     7     6     3
  C     1.53530194  1  119.3226553  1 -158.7507524  1    15     7     6
  C     1.53903051  1  113.3204619  1   86.9676905  1    16    15     7
  C     1.53500328  1  112.6124631  1 -122.2334390  1    17    16    15
  C     1.53570895  1  112.7252159  1   79.9342960  1    18    17    16
  C     1.53666889  1  112.2243382  1  -56.2990476  1    19    18    17
  C     1.53512493  1  112.5805147  1   90.8982872  1    20    19    18
  C     1.55916660  1  108.7495422  1 -119.2123960  1    12     8     7
  C     1.53575039  1  115.5525110  1  -50.9502040  1    22    12     8
  C     1.55339061  1  111.3901643  1  121.1964813  1    12     8     7
  C     1.53805703  1  116.0324391  1   53.2728518  1    24    12     8
  C     1.53562673  1  114.0525949  1  109.2636618  1    25    24    12
  C     1.53253405  1  114.9508146  1  -50.4965903  1    26    25    24
  C     1.53377321  1  114.5807846  1  -61.5850387  1    27    26    25
  H     1.08607622  1  120.4876067  1 -179.7976350  1     1     2     3
  H     1.08804668  1  120.0209929  1  179.8461030  1     2     1     3
  H     1.09128825  1  117.8848023  1  179.7539805  1     3     2     1
  H     1.08809882  1  119.9292764  1  179.8964117  1     4     1     2
  H     1.08911455  1  117.7056354  1 -179.1969816  1     5     4     1
  H     1.08955536  1  120.3828187  1  -40.1675604  1     9     8     7
  H     1.08796026  1  119.6772878  1 -179.7102576  1    10     9     8
  H     1.08897150  1  120.1903622  1   36.8343664  1    11     8     7
  H     1.08779436  1  119.7482967  1  179.6554931  1    13    11     8
  H     1.08624467  1  120.3756209  1 -179.8208093  1    14    10     9
  H     1.11216624  1  107.9455122  1  -36.6411996  1    15     7     6
  H     1.10838639  1  108.4861123  1   77.4576298  1    15     7     6
  H     1.10751746  1  108.5208240  1 -151.8104715  1    16    15     7
  H     1.10646254  1  110.5563725  1  -37.9336518  1    16    15     7
  H     1.10605463  1  109.3017747  1  116.1813460  1    17    16    15
  H     1.10568840  1  110.6894049  1    0.6463256  1    17    16    15
  H     1.10629773  1  109.8972675  1  -42.9812895  1    18    17    16
  H     1.10665881  1  109.4507384  1 -158.4401937  1    18    17    16
  H     1.10672423  1  108.9633110  1 -177.5988664  1    19    18    17
  H     1.10500821  1  110.0010521  1   67.1751864  1    19    18    17
  H     1.10485694  1  108.6138711  1  -32.6569041  1    20    19    18
  H     1.10573682  1  109.3784559  1 -147.1604343  1    20    19    18
  H     1.10882117  1  106.7871480  1  110.3589019  1    21    20    19
  H     1.11152217  1  109.0956622  1   -2.2093357  1    21    20    19
  H     1.10897772  1  109.0272249  1 -173.6382306  1    22    12     8
  H     1.10576004  1  109.4167354  1   72.2838751  1    22    12     8
  H     1.10729052  1  109.3526880  1  127.8025169  1    23    22    12
  H     1.10732006  1  110.6875114  1   13.0991894  1    23    22    12
  H     1.10661023  1  109.1419398  1  -69.5091424  1    24    12     8
  H     1.10715601  1  108.6590107  1  176.0140213  1    24    12     8
  H     1.10773653  1  109.1983171  1 -129.4284724  1    25    24    12
  H     1.10744640  1  110.6584413  1  -14.4725383  1    25    24    12
  H     1.10743478  1  108.6835691  1 -173.3218203  1    26    25    24
  H     1.10790201  1  109.0849212  1   71.7172836  1    26    25    24
  H     1.10865091  1  108.6539785  1  176.7515959  1    27    26    25
  H     1.10828870  1  109.6408830  1   62.4568586  1    27    26    25
  H     1.10671991  1  109.3601577  1  -56.4736098  1    28    27    26
  H     1.10825468  1  108.3451516  1 -171.4704561  1    28    27    26