! 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   3.3440728093   0.8290255191   1.2120160274
Cl  -5.4376947136  -0.4937685787  -0.9366905131
O    0.3380600225   0.5350058495   2.0451854982
N    2.3372453294  -2.6482805486  -0.8447410471
N    1.5134049070  -3.3339813211   1.2556068252
C    0.3434659462   0.1964407922   0.6803772533
C   -1.1207522342   0.0104444624   0.2852244432
C    1.0062365053   1.3203959587  -0.1322663523
C    1.0481707980  -1.1378548631   0.4659081827
C   -1.4572349375  -0.6268018000  -0.9068215260
C   -2.1464468335   0.4903126887   1.0911279706
C    2.3455338015   1.6726898269   0.0594903466
C    0.2947810786   2.0749337244  -1.0616133165
C    1.7723711119  -1.4604492554  -0.6715302156
C    0.9476799607  -2.1466215171   1.4154452920
C   -2.7774611666  -0.7794696679  -1.2937786984
C   -3.4757462087   0.3337579819   0.7222634127
C    2.9509445672   2.7000120649  -0.6444370303
C    0.8828239201   3.1092608353  -1.7747837482
C   -3.7822311194  -0.2986894264  -0.4690543898
C    2.2149732421   3.4218266863  -1.5703277096
C    2.1832933811  -3.5272377180   0.1303941389
H   -0.6912110495  -1.0125191626  -1.5669854955
H   -1.9333368072   0.9972999565   2.0206631118
H   -0.7479042328   1.8579648582  -1.2428362250
H    1.2429387863   0.5742963849   2.3764690515
H    1.9083352732  -0.7446153555  -1.4760622307
H    0.3941831268  -1.9955483487   2.3353164243
H   -3.0133044432  -1.2735491116  -2.2263459074
H   -4.2596574856   0.7080329577   1.3665928739
H    3.9908566781   2.9385275560  -0.4673485829
H    0.2920308651   3.6672106447  -2.4885924929
H    2.6871544922   4.2238955194  -2.1214533783
H    2.6449801490  -4.4980573094  -0.0051347301
*