! 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  -0.9128325551  -0.3135164058  -2.0654438250
Cl  -3.2580804718   3.5921998211   0.7125456346
F    3.6224866528  -1.0682104665  -0.3743332150
F    2.1713725547   0.3731512949  -1.0630187507
F    3.4987738678   2.3707423926   0.2977228344
F    4.6987286193   1.2877422965  -1.1703553483
O    2.3891415008   0.0333173434   1.1380916938
N   -1.6338611212  -2.7289842481   0.4096280368
N   -1.5437411346  -3.4437452703  -0.7152985264
N   -3.6087851141  -2.5951693323  -0.4881190749
C    0.3269096774  -1.2589917094   0.6345929979
C   -0.4728999731  -2.4364654115   1.2124248877
C    1.5975033083  -1.1146088777   1.4653439656
C   -0.5222248585  -0.0128245366   0.6148507630
C   -1.1390136645   0.4694015934  -0.5371555650
C   -0.7970837725   0.6634854716   1.8021455258
C    3.0208999011   0.1002141629  -0.0410501241
C   -1.9759018147   1.5764821750  -0.5219774038
C   -1.6296017293   1.7671545064   1.8536471844
C   -2.8611806985  -2.2185984614   0.5199539433
C   -2.2120520188   2.2165870290   0.6804051648
C    4.0945826978   1.1861437312   0.0339847974
C   -2.7479843354  -3.3362833260  -1.2110462008
H    0.6059492628  -1.5387855733  -0.3813889419
H    0.1449913148  -3.3323507603   1.2551081411
H   -0.8082595005  -2.2204654796   2.2267439807
H    1.3662485547  -0.9792224004   2.5207534851
H    2.1931492227  -2.0256714150   1.3868137934
H   -0.3592278093   0.3188132463   2.7303501628
H   -2.4367386249   1.9257506415  -1.4353273811
H   -1.8206352121   2.2627899523   2.7951076043
H   -3.1702741767  -1.6071475410   1.3533088824
H    4.8383798605   0.9688593909   0.8005022193
H   -3.0222904018  -3.8188906325  -2.1357955111
*