! wb97m-v ma-def2-qzvp SP TIGHTSCF SMD(benzene)

%pal
nprocs 10
end

%maxcore 3500

*xyz 0 1
  C           3.56941365542745     -0.84557245668077     -1.17092335556180
  C           2.79437387555740     -1.75919194528029     -0.20008351938524
  C           2.30457565536849      1.77541128285984      0.94510951034829
  C           1.36935571144411     -1.35071211881413      0.05383488419191
  C           1.93489451717528      0.47992405659099      1.69440200447360
  C           1.02471835676216     -0.39405919635217      0.90687993823216
  H           2.98174809105192     -0.71599349065119     -2.08971684196405
  H           3.34801273484616     -1.81670075925600      0.74642368713578
  H           1.42943338811436      2.43820691283026      0.90513528611466
  H           1.46775819890976      0.72677520778989      2.65454734555908
  H           4.48398132211067     -1.38025377486002     -1.46008556980710
  H           2.78860247715062     -2.77411859309530     -0.61306747076310
  H           3.05939277524956      2.29914149737812      1.54637884593907
  H           2.84771714992841     -0.08398451401551      1.91471606689554
  C           3.97229702592086      0.53858575225841     -0.63730401016533
  H           4.70454833144401      0.94423497295556     -1.34608746642036
  H           4.51862530332497      0.42304630197312      0.31070218398195
  C           2.82969181293179      1.56351834411110     -0.48024936927821
  H           3.17062282340682      2.54124306571027     -0.84169889402818
  H           1.99956693808520      1.27673583497124     -1.13522572695708
  H           0.58599922879208     -1.85025117059498     -0.51099529983641
  O          -0.35586013317653     -0.09653089959099      1.11716475893922
  S          -1.20311888527075      0.78891312254470      0.02644323434715
  C          -2.61333647250050     -0.45931478964977     -0.21063691319922
  O          -1.77415545564895      1.93684457683809      0.71195776348455
  O          -0.49012754828468      0.89164476047359     -1.24008339623802
  F          -3.48803860793426      0.06027379871773     -1.07355433664907
  F          -3.21723796369657     -0.69580381130324      0.95171295650893
  F          -2.12977330648984     -1.60235596785856     -0.70429429589875
*

