! wB97X-D3BJ Opt Freq def2-TZVPP def2/J RIJCOSX VeryTightSCF
! PAL8 VeryTightOpt defgrid3

%maxcore 4096

%geom
  MaxIter 400
  # MaxStep 0.1
  Calc_Hess true
  # Recalc_Hess 2
end

%method
  Z_tol 1e-10
end
  
%chelpg
  grid 0.1
  rmax 3.0
end

* xyz 1 2
C        1.1914670439     -0.1803686295      0.0707298606                 
C        0.9686306457     -1.5584143631      0.0635253211                 
C       -0.3319073852     -2.0550412706     -0.0005159185                 
C       -1.4101459758     -1.1742225649     -0.0613692435                 
C       -1.1885814802      0.2040318083     -0.0542436456                 
C        0.1137578999      0.7126688489      0.0248769640                 
C        0.3544103803      2.1927700294     -0.0036498513                 
H        2.2121235306      0.1927409475      0.1133882414                 
H        1.8106111064     -2.2442260246      0.1049137822                 
H       -0.5048050106     -3.1277862422     -0.0073518211                 
H       -2.4244612548     -1.5602331628     -0.1174343518                 
H       -2.0392447533      0.8793454217     -0.1098418177                 
H        0.4662428098      2.5338513166     -1.0374232066                 
H        1.2599518281      2.4519871577      0.5549258704                 
H       -0.4780483847      2.7328977276      0.4594688164  
*