Accuracy

cyc6h12r    193 Cyclohexane (Geo)

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    #  Species Formula
   183 4-Methyl cyclopenteneC6H10
   184 BicyclopropylC6H10
   185 Cyclohexene (Geo)C6H10
   186 CyclohexeneC6H10
   187 Cyclohexyl, cationC6H11
   188 1-HexeneC6H12
   189 2,3-Dimethyl-1-buteneC6H12
   190 2,3-Dimethyl-2-buteneC6H12
   191 (Z)-3-Methyl-2-penteneC6H12
   192 4-Methyl-1-penteneC6H12
   193 Cyclohexane (Geo) C6H12
   194 CyclohexaneC6H12
   195 2,2-Dimethyl butaneC6H14
   196 2,3-Dimethyl butaneC6H14
   197 2-Methyl pentaneC6H14
   198 3-Methyl pentaneC6H14
   199 n-HexaneC6H14
   200 Phenyl lithiumH5LiC6
   201 TriethylboraneH15BC6
   202 Benzyl, cationC7H7
   203 Tropylium, cationC7H7


REF: O. Bastiansen, L. Fernholt, H. M. Seip, H. Kambara, K. Kuchitsu, J. Mol. Struct., 18, 163 (1973).
  
 PM7
Cyclohexane
 GR=BFSK1973 <C-C> <> <C-C-C> <><> <C-C-C-C>
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.53600000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.53433185 +1  111.4000000 +1    0.0000000 +0     2     1     0
  C     1.53528985 +1  110.9794253 +1   54.9000000 +1     3     2     1
  C     1.53410942 +1  110.8698456 +1  -55.7811314 +1     4     3     2
  C     1.53453808 +1  110.4217154 +1   57.5559229 +1     5     4     3
  H     1.10465311 +1  110.0365937 +1 -177.8227326 +1     1     2     3
  H     1.10581349 +1  109.7663592 +1   65.6627603 +1     1     2     3
  H     1.10494073 +1  109.9449429 +1 -122.1881446 +1     2     1     3
  H     1.10630263 +1  109.5920775 +1  121.5342200 +1     2     1     3
  H     1.10503374 +1  110.0858669 +1  176.9868195 +1     3     2     1
  H     1.10577448 +1  109.7250638 +1  -66.5218585 +1     3     2     1
  H     1.10506591 +1  110.0180211 +1 -177.8281319 +1     4     3     2
  H     1.10580481 +1  109.7355583 +1   65.7055189 +1     4     3     2
  H     1.10473795 +1  110.1430525 +1  179.4350392 +1     5     4     3
  H     1.10572861 +1  109.9558832 +1  -63.9071744 +1     5     4     3
  H     1.10470535 +1  110.1650984 +1  179.9397861 +1     6     5     4
  H     1.10575002 +1  109.9678307 +1   63.2600642 +1     6     5     4