! 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  -6.8137289690   0.3819390260   0.3685324688
F    2.7724731135  -2.9647163722   1.0253399170
F    4.1438600837  -1.7824661931  -0.0932910248
F    3.3650310369  -1.0715263433   1.8024657146
O    4.0857099378   0.8782494498   0.0740901893
O   -1.5862925454  -2.1143280292  -0.5200304362
N    1.8083451420   2.7609418623   0.2343897402
N    2.2508100066   2.5083464367   1.4721504798
N    0.0799874409   3.0515600296   1.5209775882
C    3.1420267249   1.0479398883  -0.9542434504
C    1.9466655271   0.0924186021  -0.8360839671
C    2.6515271612   2.5143172539  -0.9120714751
C    3.8613091784   0.8224418288  -2.2787752198
C    1.8792821983  -1.0791574592  -0.0650631674
C    0.8097578837   0.4237582978  -1.5763894957
C    0.6761256536  -1.7781730199   0.0371428472
C   -0.3732880444  -0.2821355080  -1.5079235254
C   -0.4448978355  -1.3691626110  -0.6559480937
C    3.0481198361  -1.7003601947   0.6642898387
C    0.5127883145   3.0624471231   0.2808596479
C    1.1814100121   2.6974168609   2.2043055365
C   -2.7794031575  -1.4717562969  -0.3163264639
C   -3.9166929268  -2.0895815466  -0.8164605472
C   -2.8797148954  -0.2840890043   0.3978746042
C   -5.1622523840  -1.5229956913  -0.6006378263
C   -4.1253907316   0.2876989060   0.6048465306
C   -5.2583053336  -0.3342046988   0.1053922763
H    3.5246883878   3.1654815886  -0.8621497596
H    2.0956466400   2.8016977429  -1.8001538571
H    3.1785356994   0.9299531282  -3.1206299807
H    4.6705579438   1.5434720214  -2.4056759485
H    4.2869161651  -0.1795240269  -2.3198974605
H    0.8333655391   1.2714900379  -2.2470682622
H    0.5935250759  -2.6607842357   0.6547906041
H    3.7218425769   1.2660883699   0.8860952085
H   -1.2207370702   0.0266902937  -2.1057185298
H   -0.0660233929   3.3051726316  -0.5959086837
H    1.2039532671   2.5814069815   3.2763275029
H   -3.8325594259  -3.0149824527  -1.3709984138
H   -2.0040954074   0.2048845511   0.8049568342
H   -6.0464739796  -2.0080939790  -0.9902970022
H   -4.2028042386   1.2117756580   1.1610067717
*