! 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  -0.7210687623  -0.3831068542   2.2999974475
F    4.1713664554  -1.4790922506  -1.2622862078
F    5.7667828855  -0.0681195823  -1.0177959061
F    4.9489360185  -1.0472988531   0.7023007064
F   -5.8739252977   1.0947628378  -0.9289536482
F   -5.2314425876   1.9939816940   0.9184548097
F   -4.2655665826   2.5222005302  -0.9253743931
O    2.1340043207  -1.8080843003   0.7828745895
N    0.7417467052  -1.3571094000  -0.9364463716
N   -2.9127144170  -1.6968613955  -0.7211984803
C   -0.9725728536  -2.7338634568   0.2477532499
C    0.0342737167  -2.6189076352  -0.8996993430
C   -1.9684431588  -1.6179500425   0.2118892133
C    2.2541423609   0.3511705770  -0.2070770996
C    1.7145131885  -1.0425587584  -0.0729858865
C    3.6226370578   0.6147113603  -0.3313237962
C   -1.9207424341  -0.5130093940   1.0642802244
C   -3.8103615829   0.3978931398  -0.0479857518
C   -2.8426197825   0.5080621215   0.9363944613
C    1.3653448727   1.4168575092  -0.1319028908
C    4.0736890860   1.9272364426  -0.3585290155
C   -3.8048432006  -0.7297638852  -0.8531725337
C    4.6226762723  -0.4968502209  -0.4718436634
C    1.8213076296   2.7267406510  -0.1519165333
C    3.1770733756   2.9812645366  -0.2584626628
C   -4.8006447310   1.4987006250  -0.2465635811
H   -1.5011743019  -3.6803356784   0.1273634550
H   -0.4498549828  -2.7775561565   1.2004613969
H    0.7468353657  -3.4408384015  -0.8307910934
H   -0.4794852368  -2.7223603719  -1.8527845551
H    0.4543319354  -0.6741162553  -1.6188936187
H   -2.7991010765   1.3635794385   1.5974340744
H    0.3033972423   1.2298338156  -0.0428423004
H    5.1262940148   2.1476218813  -0.4650001165
H   -4.5410122374  -0.8692860571  -1.6343139132
H    1.1146096939   3.5421060586  -0.0821954854
H    3.5447056121   3.9977944043  -0.2759079659
*