! wb97x-d3
! def2-TZVPP
! def2/J RIJCOSX GRIDX6 NOFINALGRIDX
! grid4 nofinalgrid
! scfconv7
! smallprint printgap noloewdin
! NOSOSCF
%MaxCore 8000
%output
       print[P_BondOrder_M] 1
       print[P_Mayer] 1
       print[P_basis] 2
end
%pal
    nprocs 8
end
%cpcm
    smd    true
    smdsolvent "WATER"
end
*xyz 0 1
Cl  -5.3200173368   0.9329865352   0.9679637169
F   -0.3200224085  -0.2514692029  -2.1856158639
F   -0.8092793410  -2.2366815668  -1.5155070833
F   -2.2472856173  -1.0903082159  -2.6174244633
O    2.3446112288   2.1722989670   0.6406794743
N    2.5743081057  -0.6640756907   0.8760137905
N    0.3232562615  -0.7419697319   0.6395785948
N    4.6907684380  -1.1262195510   1.2934163452
C    1.3305704897  -0.0283784864   0.9223262193
C    1.3492393913   1.4386734205   1.2957770839
C    2.0543094729   2.5288233427  -0.7058854175
C   -0.9827465105  -0.2804714070   0.7060268883
C    2.5614163402   1.5412027288  -1.7417131038
C   -1.8358740107  -0.4339835061  -0.3956196994
C   -1.5133011397   0.2262107872   1.8912756052
C   -3.1655970962  -0.0486475212  -0.3149707872
C    2.8561988071  -1.8393877737   0.2113091142
C    4.0706323917   1.3616515508  -1.7354467856
C    3.7279000314  -0.2809915534   1.5009270253
C   -1.3037586731  -1.0044977102  -1.6750333330
C   -2.8417946465   0.5999882159   1.9808184040
C   -3.6585227310   0.4661562310   0.8720121876
C    4.1589118991  -2.0976773953   0.4773904028
H    1.5298382199   1.5238547873   2.3713161181
H    0.3568804243   1.8618754410   1.1085002019
H    2.5351209687   3.4963247036  -0.8696795252
H    0.9757896554   2.6840527680  -0.8273953087
H    2.0672501498   0.5734166387  -1.6373692947
H    2.2446732770   1.9288681252  -2.7138375673
H   -0.8835744910   0.3061504687   2.7677913316
H   -3.8253238816  -0.1494451346  -1.1649304096
H    2.1208162257  -2.3560025546  -0.3800047427
H    4.4334569187   0.9507087886  -0.7936332710
H    4.3835128780   0.6818732776  -2.5281134197
H    4.5813797281   2.3128017266  -1.8976198838
H    3.8005829877   0.5988705298   2.1179003537
H   -3.2287336418   0.9898707922   2.9119346953
H    4.7495051231  -2.9276729958   0.1250650437
*