! 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   0.8446563898   2.9834941593  -2.4747774700
Cl   1.1480149440   4.7404953626   0.1154684877
F    4.9909901853  -3.3476353242   0.4689758567
F   -1.5728472238   0.7658496009  -1.5037184578
F   -1.3034029063   1.3008777218   0.5955146660
O   -1.4529511887  -3.5047372784   0.0009404083
N   -0.2441113064  -1.6066618478   0.3303646165
N   -4.8073580852  -1.2140449233   0.5297194456
N   -4.3309789284  -0.0179480130   0.2185450345
C    2.1158076502  -1.1644811227   0.3358682124
C    1.0686427632  -2.1013997269   0.3268972477
C   -2.6583985568  -1.5262205400   0.2568071734
C    1.8576376172   0.2959828071   0.2848578683
C   -3.0349232247  -0.1773303594   0.0538992238
C   -1.4021774599  -2.2973615647   0.1744145303
C   -3.8542059784  -2.1486087267   0.5569402787
C    3.4351565436  -1.5941807599   0.3949775715
C    1.3845337387  -3.4613634219   0.3482902091
C    1.5028819493   0.8986891536  -0.9160684094
C    1.9915178304   1.0804345569   1.4262066907
C    3.7117103099  -2.9443220954   0.4198345305
C    2.7043899322  -3.8825132460   0.3894988713
C   -2.2501181139   1.0122032514  -0.3511349533
C   -6.2160898101  -1.4002104841   0.7993610279
C    1.2883321093   2.2657169838  -0.9756718918
C    1.7757928379   2.4462930298   1.3687977302
C    1.4221010607   3.0424611885   0.1688119958
H   -0.3250155718  -0.6281014372   0.5610659385
H   -4.0697903982  -3.1783632624   0.7924846325
H    4.2403820651  -0.8706498551   0.4063085888
H    0.6097731887  -4.2082261005   0.3428741590
H    1.4051412912   0.3037832925  -1.8143479971
H    2.2639661029   0.6254943566   2.3693842627
H   -2.8799267941   1.8916981505  -0.4850737279
H    2.9334910384  -4.9399354081   0.4054032140
H   -6.3667887105  -1.7226023887   1.8274599915
H   -6.7230586332  -0.4532508336   0.6447416182
H   -6.6342181315  -2.1433434543   0.1241372136
H    1.8804473557   3.0499269353   2.2599056478
*