#
#Single Point
#
! wb97x-d3bj def2-tzvppd def2/J tightscf defgrid3
%pal nprocs 4 end
%maxcore 8000
%scf guess moread
moinp "SP_prod4Frz.gbw" end

* xyz 1 1
  C           0.17106406089132     -2.74503012195442      0.00685521258366
  C           0.62374574638129     -2.24929057137974      1.22683180853828
  C           1.02284304185110     -0.93347215687490      1.29933393859772
  C           0.97524150109134     -0.10224842152768      0.14879884236590
  C           0.50917659059133     -0.64083841655026     -1.08246311954424
  C           0.11114365828395     -1.95113686666330     -1.14613332264791
  H           0.65386995790267     -2.89013708078400      2.09807668136866
  H           1.37625145183977     -0.51938640378991      2.23735441850963
  H           0.46569860692435     -0.02100630167490     -1.96840644126558
  H          -0.25009107844839     -2.37721541218481     -2.07398567689818
  C           1.39487680309859      1.21807749123468      0.27978801419005
  H           1.72237234138604      1.52674372836747      1.27206709303822
  H           2.36789585446595      2.76785160480633     -0.70802569662308
  H           1.22007144556411      1.90298682495778     -1.73868055915127
  C           0.32956916428013      3.30912372973411     -0.34475036052130
  C          -1.02110588617351      2.99868559804186     -0.47646601141102
  C           0.71648062737993      4.54627583201468      0.16281736024655
  C          -1.98209601998992      3.94077915350406     -0.13454810684294
  H          -1.32726464968007      2.03076054655780     -0.86214390013537
  C          -0.24627156560319      5.48436105356245      0.50428777962262
  H           1.76914090198382      4.78686432179636      0.26912964000566
  C          -1.59466434839125      5.18188822829558      0.35638286130808
  H          -3.03351265421972      3.70559984396069     -0.25072904122646
  H           0.05642646639330      6.45439231719487      0.88068752769413
  H          -2.34620030481398      5.91597396924789      0.62244045456768
  C           1.38850303796676      2.27851397668073     -0.73059421318339
  C          -0.25450635530974     -4.20391182463747     -0.11473628197893
  F          -1.41957640351242     -4.29367496814160     -0.76635214040813
  F          -0.39235408592310     -4.78028539716766      1.08047101083337
  F           0.67015418378953     -4.87898693662668     -0.80931165163243
*

