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

* xyz 1 1
 C                 -0.54667400   -2.16276800   -0.21523200
 C                  0.82057000   -2.28031500    0.03047500
 C                  1.54005000   -1.21859100    0.56367000
 C                  0.88320800   -0.02505700    0.87051600
 C                 -0.48043800    0.10304800    0.61288000
 C                 -1.19086200   -0.96662200    0.07688800
 H                  2.60229200   -1.33175600    0.75351500
 H                 -0.99925000    1.03192800    0.82948700
 C                  1.65248600    1.16129100    1.46255000
 H                  1.13550300    1.58252600    2.32468400
 H                  2.64828000    0.83260900    1.77338100
 H                  2.44653300    1.75112400   -0.47001600
 C                  1.04591600    3.24581200    0.06860800
 C                  1.23532500    3.90129500   -1.18694900
 C                  0.13083000    3.80360500    1.01410600
 C                  0.53870800    5.05336700   -1.48249800
 H                  1.93030800    3.48009600   -1.90746800
 C                 -0.55912600    4.95331900    0.70577600
 H                 -0.02024700    3.32798900    1.97666500
 C                 -0.35579800    5.57285600   -0.53852300
 H                  0.67708700    5.55230300   -2.43444800
 H                 -1.25521600    5.38257300    1.41703300
 H                 -0.90499500    6.47987600   -0.77270400
 C                  1.76324000    2.07946700    0.31426700
 C                  1.50513300   -3.59311600   -0.28345000
 F                  2.83175400   -3.51917400   -0.09382200
 F                  1.29245500   -3.94991300   -1.55990700
 F                  1.03295100   -4.57747000    0.49571200
 H                 -1.09959400   -2.99473800   -0.63828900
 C                 -2.67917100   -0.82987900   -0.15320000
 F                 -3.02229100    0.45692900   -0.36116600
 F                 -3.37266700   -1.26009500    0.91270000
 F                 -3.08192100   -1.53665800   -1.21564600
*

