! 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 "1-OCTANOL"
end
*xyz 0 1
Cl  -1.4884004971   1.3354802762  -2.8939817573
Cl  -4.9241703889   3.0141995849   0.8382277821
F    3.6510730773   0.1142504374   1.8261634369
F    3.0992145877  -1.8750816458   1.1928520457
F    5.1555418207   0.4595576692  -0.4244735881
F    4.5479474410  -1.5103605826  -1.1516825368
O    2.4930547894  -0.1364514228  -0.0686635100
N   -0.6761639593  -2.0962388411  -0.0757634585
N   -1.9814982031  -2.0176682553   0.1911758740
N   -1.0133228465  -3.5727286647   1.4788235086
C    0.2056306908   0.1815144152  -0.6072732190
C   -0.0564381435  -1.2586262205  -1.0751909196
C    1.2386605758   0.2538870165   0.5086223862
C   -1.0696823669   0.8989701600  -0.2417919351
C   -1.9060567567   1.4450950420  -1.2137604633
C   -1.4848534477   1.0267385261   1.0809507784
C    3.4383238354  -0.6434320324   0.7226252848
C   -3.0902898141   2.0925091365  -0.9000777365
C   -2.6580060509   1.6724915764   1.4306633835
C   -0.1123170326  -3.0292983231   0.6978092210
C   -3.4542947162   2.2009842114   0.4302686560
C    4.7576387442  -0.7729975038  -0.0387679933
C   -2.1372189611  -2.9170689028   1.1284675399
H    0.6452416542   0.6907350433  -1.4698833182
H   -0.6959628020  -1.2572243439  -1.9558845496
H    0.8804325462  -1.7295886661  -1.3697972291
H    1.3213934690   1.2767073895   0.8786730267
H    0.9789553863  -0.3914824438   1.3504235577
H   -0.8851850808   0.6127648725   1.8806636711
H   -3.7126093576   2.5060609407  -1.6813658632
H   -2.9422943446   1.7549014490   2.4704335344
H    0.9351190614  -3.2809148051   0.6478755753
H    5.5367025586  -1.2371671975   0.5677951830
H   -3.1005283286  -3.1125089241   1.5737364351
*