! 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  -5.1442681873   1.5126862962  -0.0517672949
F   -0.5457383694  -2.1278502057   1.4002127103
F   -2.5533443409  -2.8036257084   1.0461159500
F   -1.0869983735  -2.9438706112  -0.5143529922
O    2.2146001214   1.5268056232   1.3971371676
N    2.5907177549  -0.6646893763  -0.4398478275
N    0.3614537096  -0.4562969542  -0.8296709016
N    4.1435263630  -1.5578038471  -1.7302689562
C    1.3309432812  -0.2047482738  -0.0561200402
C    1.2560860747   0.5188181534   1.2723345681
C    1.9697197741   2.6560364508   0.5756325292
C   -0.9231876935   0.0175820211  -0.5837639561
C    3.1291198344   3.6184307736   0.7051800111
C   -1.8962884259  -0.7950748493   0.0091996494
C   -1.2860938148   1.2914142093  -1.0138748778
C   -3.1941981515  -0.3312075600   0.1744970692
C    3.7353560719  -0.7620821228   0.3296495795
C    4.4523371439   3.0393044861   0.2264934284
C    2.9098444853  -1.1656531021  -1.6742125137
C   -1.5256759829  -2.1668845116   0.4813175468
C   -2.5773812223   1.7579227576  -0.8505870411
C   -3.5244814851   0.9407684453  -0.2567978562
C    4.6669508967  -1.3166668359  -0.4798775844
H    1.4310261413  -0.2047701784   2.0726248781
H    0.2410669416   0.9061910785   1.4092258250
H    1.0310647044   3.1386872831   0.8754422249
H    1.8585013321   2.3592686442  -0.4770813923
H    2.8782698711   4.5050371023   0.1186024454
H    3.2128655393   3.9522291545   1.7430550144
H   -0.5461538691   1.9223083709  -1.4882403288
H   -3.9489898252  -0.9504963074   0.6377891283
H    3.7918723322  -0.4520183241   1.3568954907
H    5.2461836869   3.7846276926   0.2831110857
H    4.7639917219   2.1834983563   0.8248940890
H    4.3852749052   2.7072969073  -0.8112960049
H    2.1973409273  -1.2030448015  -2.4808968780
H   -2.8366638498   2.7522324239  -1.1868940142
H    5.6888777185  -1.5563938299  -0.2354657889
*