#
#Single Point
#
! wb97x-d3bj def2-tzvppd def2/J tightscf defgrid3
%pal nprocs 4 end
%maxcore 8000
%scf guess moread
moinp "oldSP_ts24.gbw" end

* xyz 1 1
  C          -0.16535347426940     -2.69119895369030     -0.02744357585894
  C           1.13786396254402     -2.21615496633435     -0.08743637640139
  C           1.38211449674470     -0.85489206272624     -0.08554588848863
  C           0.31085030009621      0.04293864927695     -0.03356100775255
  C          -1.00231227272564     -0.43600857878970      0.04154911608981
  C          -1.23024990171636     -1.79756237246969      0.04045153808844
  H           2.40197072492646     -0.49071236417764     -0.13329011333155
  H          -1.84463413009543      0.23939706671888      0.12049728506344
  C           0.61596542934703      1.46565248717762     -0.03350481083916
  H           1.64526359806523      1.74683667729048      0.17991608729364
  H           0.40222621125924      2.06095531270909     -1.26442239055895
  H          -1.29629712704675      2.24033511655187     -0.56840357419876
  C          -0.01057470983905      3.94386799495480     -0.09884372759343
  C          -0.88025704504156      4.85807843778717     -0.70010849411410
  C           1.06472004467320      4.40081701093540      0.66989190693895
  C          -0.66442287105317      6.21816756066117     -0.55263418920535
  H          -1.72243517373063      4.50232536042134     -1.28493290280825
  C           1.27295923332809      5.76037258287057      0.81637793035919
  H           1.72205883026848      3.70619248847507      1.18098925573679
  C           0.41313402582007      6.66707288415095      0.20151358353611
  H          -1.33680496853856      6.92700539520773     -1.02028137048989
  H           2.09815286230215      6.11803872958629      1.42019518187637
  H           0.57949270278563      7.73125204914006      0.32280095871101
  C          -0.27956544495999      2.51509522307042     -0.29541073313880
  C          -2.63930225922407     -2.34745001682544      0.14657566650056
  F          -3.55542056481927     -1.38009350693616     -0.01893136966244
  F          -2.83963043944554     -2.90443097289899      1.34879610599512
  F          -2.85291869809916     -3.28704131501958     -0.78308891678141
  C           2.28219503109605     -3.21030795411696     -0.12653204438471
  F           3.44272469453440     -2.60678574609690     -0.42380402767306
  F           2.05730592498448     -4.15902533647467     -1.04428641512937
  F           2.42239964789059     -3.81309171446537      1.06265745160843
  H          -0.35429364006139     -3.75937016596395     -0.03021913938712
*

