#
#Single Point
#
! wb97x-d3bj def2-tzvppd def2/J tightscf defgrid3
%pal nprocs 4 end
%maxcore 8000
%scf guess moread
moinp "oldSP_ts6.gbw" end

* xyz 1 1
  C           0.14475145646141     -3.77023425851381     -0.03726125159691
  C           1.38219674523117     -3.19450600244655     -0.36659602735645
  C           1.51510917554404     -1.82869872191331     -0.40299074284873
  C           0.42202956713559     -0.99261247293387     -0.12131554036018
  C          -0.80126829960256     -1.57378907656721      0.21958677611103
  C          -0.94868296997629     -2.94695693659446      0.26386881344106
  H           2.21659876550590     -3.84998880236891     -0.58258722773610
  H           2.47653999928955     -1.39325999905017     -0.65639099746909
  H          -1.65258128110132     -0.95677543260656      0.48606625104433
  H          -1.90215798828050     -3.37051303858760      0.54615774055350
  C           0.61824095773660      0.45238424584097     -0.18821409110597
  H           1.63891689862242      0.81401533268427     -0.08342453562535
  H           0.28451062507759      0.91096762063853     -1.31699879014145
  H          -1.40851617526220      1.06925636244920     -0.38758928957658
  C          -0.22654833058537      2.86019183691295     -0.06129747209497
  C          -1.28563980265698      3.69095256862577     -0.45084960309484
  C           0.93931684807357      3.42202923381944      0.47891262408172
  C          -1.17303752613433      5.06430845767253     -0.32495480585900
  H          -2.19260550447876      3.25413934397337     -0.85608294514309
  C           1.04466669542373      4.79371344652744      0.60420849335824
  H           1.74972730485508      2.79158901902518      0.82584820542873
  C          -0.00759422121955      5.61272114680532      0.19838763494008
  H          -1.99026416352371      5.70682270343894     -0.62898653296687
  H           1.93996682363320      5.23125527079327      1.02888664907824
  H           0.08016955288572      6.68818409461593      0.30296895696503
  C          -0.39613281140895      1.42908072677755     -0.21535020212382
  O           0.11160227251781     -5.10521492712252     -0.02350860241646
  C          -1.11666315438600     -5.75896296573504      0.30750992676375
  H          -0.90660806452757     -6.82374432802772      0.24582624770015
  H          -1.42844644700915     -5.50380783003953      1.32344430597413
  H          -1.89936128784007     -5.49593303809338     -0.40845625792412
*

