! 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  -5.3249021295   1.3332961650  -0.4020502392
F   -2.2347720726  -2.1387057989   1.7957501919
F   -0.8128862444  -2.6478890850   0.2722764184
F   -0.3086424580  -1.1921379327   1.7736682882
O    2.2932674431   2.0739151699   0.6471506457
N    2.5537900021  -0.1525842275  -1.1283437599
N    0.2991244789  -0.3383477256  -0.9874740899
N    4.6804062193  -0.3156655319  -1.6919757195
C    1.3089405300   0.4090165097  -0.8319827072
C    1.3282492483   1.8398080016  -0.3388286314
C    1.9898184102   1.5540048921   1.9377936796
C   -1.0026480334   0.1056250089  -0.7996167504
C    2.6619925154   0.2268649005   2.2434339551
C   -1.8446043788  -0.5340050818   0.1191906594
C   -1.5351628394   1.1133754145  -1.6013208538
C   -3.1703650441  -0.1460591882   0.2460579444
C    2.8395099465  -1.5007205168  -1.1890064199
C    4.1797069755   0.2804705897   2.1779366751
C    3.7110494851   0.5074441768  -1.4325151106
C   -1.3023967568  -1.6284488475   0.9863849263
C   -2.8592022760   1.4958778364  -1.4870916951
C   -3.6680317268   0.8641917253  -0.5588713602
C    4.1490705555  -1.5736676719  -1.5277409290
H    0.3259964780   2.1031794859   0.0146594624
H    1.5477767163   2.5022546448  -1.1807624415
H    0.9043986111   1.4701094713   2.0667607732
H    2.3363237646   2.3018767221   2.6558674186
H    2.3500274124  -0.0495369372   3.2543655055
H    2.2881341448  -0.5662292794   1.5929737745
H   -0.9077098206   1.5916883570  -2.3421513768
H   -3.8219931814  -0.6242429606   0.9632905470
H    2.1032643709  -2.2552218647  -0.9745269826
H    4.5792964616   1.0223251607   2.8722472302
H    4.6139250743  -0.6838368827   2.4425367240
H    4.5386089839   0.5356546856   1.1812097419
H    3.7808945183   1.5811376113  -1.4831400815
H   -3.2488553364   2.2801672499  -2.1210601896
H    4.7436837301  -2.4624277250  -1.6638276135
*