#
#Opt
#
! opt freq wb97x-d3bj def2-tzvp(-f) def2/J tightscf tightopt
%pal nprocs 4 end
%maxcore 8000

* xyz 1 1
 C                 -0.16062300   -2.13593000   -0.00275200
 C                  0.03592100   -1.49922100    1.22029600
 C                  0.61467100   -0.24020700    1.26769700
 C                  1.00200800    0.39803100    0.07995500
 C                  0.81682400   -0.25103400   -1.15033200
 C                  0.23600300   -1.50803700   -1.18354700
 H                  0.76143700    0.24859400    2.22528800
 H                  1.13838300    0.20591600   -2.07912300
 C                  1.62182400    1.70840900    0.17686900
 H                  2.00250300    1.97536300    1.15914500
 H                  2.75081300    3.29639800   -0.76362100
 H                  1.78154900    2.28683700   -1.91825600
 C                  0.59473600    3.21561900   -0.29852200
 C                 -0.65466800    2.89350500   -0.87598600
 C                  0.66790200    4.20661600    0.70756600
 C                 -1.78922000    3.57785200   -0.48665900
 H                 -0.72025000    2.11176900   -1.62651300
 C                 -0.47637000    4.87723400    1.10113900
 H                  1.62679200    4.45153400    1.15607500
 C                 -1.70003400    4.56346900    0.50359100
 H                 -2.74586100    3.34822100   -0.94154600
 H                 -0.42250500    5.64382700    1.86537200
 H                 -2.59724400    5.08803700    0.81574800
 C                  1.90450200    2.62831400   -0.89469900
 H                 -0.61485700   -3.12158800   -0.03740100
 C                 -0.39985400   -2.20283100    2.48863700
 F                 -0.08978800   -1.48769200    3.58010500
 F                  0.18910800   -3.40108800    2.59615800
 F                 -1.72724000   -2.39961300    2.48795900
 C                  0.01542100   -2.22390200   -2.49959900
 F                  0.46956000   -1.50172900   -3.53603700
 F                 -1.29259100   -2.44965400   -2.69868900
 F                  0.63995100   -3.40785900   -2.51370900
*

