! 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  -2.2601052607   0.5341125440  -2.6781680059
Cl  -2.3737726666   5.0279417285   0.2099492296
F    2.9174822438  -1.9790097217   0.3000374413
F    3.2786553086  -0.5738797487  -1.2987017158
F    3.0574330169   0.0653387370   2.1437360013
F    3.4518373089   1.4793113952   0.5251801404
O    1.4685663859  -0.3100759198  -0.0189002815
N   -0.7695410428  -2.9490952402   0.8861211133
N   -1.6160555066  -3.7016899553   0.1800490007
N    0.1112614516  -4.9356759680   0.9074532656
C   -0.8460310134  -0.7898424816  -0.2882298167
C   -0.9718150897  -1.5283168724   1.0471311523
C    0.5352013197  -0.9350410473  -0.9094383810
C   -1.2322347857   0.6637332922  -0.1625826258
C   -1.8781786745   1.3448946147  -1.1937836172
C   -0.9295023737   1.4013189714   0.9798315687
C    2.7479230469  -0.6765964216  -0.0550853578
C   -2.2350341833   2.6808133616  -1.0954814893
C   -1.2699421352   2.7368795747   1.1102490603
C    0.2531459760  -3.6940887061   1.3039532232
C   -1.9270667972   3.3647489015   0.0669668979
C    3.5713719984   0.1863722413   0.8993479026
C   -1.0464311966  -4.8781813215   0.2255282503
H   -1.5357962450  -1.2743055576  -0.9824941556
H   -0.2438941025  -1.1916790392   1.7826475920
H   -1.9619728354  -1.3625550418   1.4696176948
H    0.7746208278  -1.9889571307  -1.0676162906
H    0.5663879449  -0.4388382124  -1.8808418270
H   -0.4157892548   0.9329927939   1.8075256721
H   -2.7424596689   3.1748298740  -1.9121865079
H   -1.0204715079   3.2739134850   2.0143210886
H    1.0559287281  -3.3032659963   1.9081951164
H    4.6241563764  -0.0978696622   0.9068766859
H   -1.4895514729  -5.7363519259  -0.2545020016
*