! 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  -0.9372623225   0.3952592247  -2.1830288285
F    5.1866903414  -1.0320495504  -0.0109435581
O   -0.3620173375   0.0504927068   2.3347634387
N   -1.5401086428  -3.2124824956  -0.5649531189
N   -3.3789503420  -1.9102372927   0.1278470321
C   -0.2660469467   0.0482226118   0.9252422729
C    1.2104881873  -0.2096499846   0.6431819156
C   -0.7242297358   1.4010285659   0.3629080769
C   -1.1641545004  -1.0725058174   0.4043599696
C    1.8656476422  -1.2061026030   1.3696157410
C    1.9417786757   0.5102890329  -0.2932370972
C   -1.0722276307   1.6315772761  -0.9701261575
C   -0.7909216914   2.4929620277   1.2272565673
C   -0.7149746403  -2.2536655313  -0.1655524446
C   -2.5439497566  -0.9616225891   0.5233472505
C    3.2035848865  -1.4912591987   1.1552074293
C    3.2841254168   0.2387993718  -0.5225773271
C   -1.5030146658   2.8760130845  -1.4086725409
C   -1.2104277397   3.7426791629   0.8012236912
C    3.8911027356  -0.7617812225   0.2047319255
C   -1.5792989581   3.9343819966  -0.5198351037
C   -2.8332199893  -2.9949324143  -0.3988697663
H    1.3337979412  -1.7829025739   2.1147336363
H    1.4909866006   1.3139545213  -0.8571296313
H   -0.5057036656   2.3661432587   2.2619613568
H   -1.2880520556   0.1009896756   2.6027418896
H    0.3401591027  -2.4348361177  -0.3306160745
H   -3.0027661068  -0.0678937954   0.9374042049
H    3.7009675272  -2.2679106468   1.7213252540
H    3.8435926859   0.8069795441  -1.2539687417
H   -1.7722797233   3.0161455615  -2.4468355777
H   -1.2490673347   4.5628608767   1.5055480836
H   -1.9169947917   4.9019256388  -0.8664589520
H   -3.5098429466  -3.7739707840  -0.7296343186
*