%chk=EDA-downPhtl_EEisomer_axb.chk
%nprocshared=40
%mem=100GB
#p opt freq wb97xd/gen scrf=(smd,solvent=dimethylsulfoxide) int=ultrafine

continue calc 

-1 1
  C     -1.712036     -3.332691      1.110306
  H     -1.706327     -3.517698      2.179953
  C     -2.593116     -4.007117      0.260632
  H     -3.295555     -4.722812      0.677722
  C     -2.596161     -3.771518     -1.113139
  H     -3.303714     -4.305718     -1.740231
  C     -1.713582     -2.854690     -1.690677
  H     -1.711524     -2.666864     -2.758954
  C     -0.848081     -2.190454     -0.843725
  C     -0.843613     -2.427562      0.531979
  N      0.685081     -0.801391      0.094757
  C      0.185183     -1.171983     -1.158969
  C      0.178071     -1.549493      1.164057
  O      0.566692     -0.726947     -2.217739
  O      0.537531     -1.448077      2.314527
  O      1.746124      0.040101      0.223273
  C      2.976075     -0.618232      0.159945
  O      3.029858     -1.810178      0.015352
  C      4.050806      0.862931      1.795507
  H      3.123640      1.409474      1.987287
  H      4.113553      0.025401      2.497320
  H      4.884949      1.536199      2.003931
  C      4.115398      0.361711      0.335476
  C      5.435023     -0.393577      0.063511
  C      3.953255      1.528403     -0.672554
  C      6.651270      0.533187      0.022662
  H      5.350699     -0.900043     -0.905827
  H      5.572747     -1.173939      0.819062
  C      5.183883      2.437188     -0.723803
  H      3.784505      1.105838     -1.671785
  H      3.065036      2.114246     -0.417589
  C      6.461955      1.647556     -1.006903
  H      7.538992     -0.062171     -0.216965
  H      6.830976      0.972722      1.011596
  H      5.025120      3.197296     -1.496312
  H      5.290829      2.975412      0.226120
  H      7.328566      2.317422     -1.009213
  H      6.397448      1.203069     -2.009697
  C     -3.457886      3.103987      1.408060
  H     -3.270901      3.173694      2.476769
  C     -3.504907      4.252800      0.609299
  H     -3.355901      5.229333      1.063529
  C     -3.741065      4.166326     -0.764514
  H     -3.773686      5.076913     -1.357560
  C     -3.936136      2.926876     -1.384931
  H     -4.121831      2.856171     -2.453630
  C     -3.887025      1.799354     -0.583613
  C     -3.652013      1.884304      0.782824
  N     -3.877688     -0.397983      0.255744
  C     -4.044055      0.326163     -0.892340
  C     -3.670233      0.459405      1.297386
  O     -4.289036     -0.117088     -2.017669
  O     -3.511846      0.151489      2.482519

-H 0
6-31g(d,p)
****
-C 0
6-31g(d,p)
****
-N 0
6-31+g(d,p)
****
-O 0
6-31+g(d,p)
****