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

%pal
nprocs 10
end

%maxcore 3500

*xyz 0 1
  C          -0.56772000321566      0.38206789486779     -0.00632099177554
  C           0.53201625201136      0.53175168772031     -0.73581736034904
  C           1.68427413196493      1.41099696921381     -0.33586631102752
  C          -0.87984168089539      1.00320617296557      1.32163599513030
  C           1.31612665485220      2.88100200484855     -0.07663514819645
  C          -0.83396794553691      2.53811214411440      1.32698758318813
  C           0.57197913351318      3.13460339059450      1.23639493231531
  H           2.43944239084467      1.36632601082407     -1.12705374538470
  H          -1.29619225801483      2.88157129704229      2.26058790637358
  H           0.60454475631117     -0.02701125631203     -1.66586858774535
  H           2.16433961529422      1.00119938986355      0.56680122684336
  H          -1.45868126612009      2.91466610035307      0.50803958642598
  H           1.17944997525104      2.75147431281255      2.07039302799559
  H           0.49607725903387      4.21891529065231      1.38770203726759
  O          -1.51335467085044     -0.58297093787229     -0.47823110844992
  S          -2.92674821414157     -0.05064330860320     -1.11139192039970
  O          -3.33550999404303      1.21159814200615     -0.50815264446525
  O          -3.78144963130185     -1.22009493670051     -1.19416331522674
  C          -2.38539792834475      0.35448548422020     -2.89386751999568
  F          -1.65507330556674      1.47166830514096     -2.91604191321868
  F          -1.67105251405216     -0.65389587679468     -3.39617540286132
  F          -3.48487151211821      0.53089760414883     -3.62791814354257
  H           0.71843005917241      3.25389386204017     -0.91922554234267
  H           2.24502303555586      3.46528234490362     -0.06482221164285
  H          -0.15930551599654      0.61874709388816      2.06041941963960
  H          -1.86767182360672      0.66399281406183      1.64403815144456
*

