! 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   0.4335257053   0.3725661456  -2.8374305314
Cl   3.7682946359  -2.5433500524   0.1620777691
O   -1.0959329919   1.8885459417   1.0262985976
N   -2.4029273287  -0.6581583571   0.3350152562
N   -2.9231295045  -1.7645849991   2.1682355413
C   -0.9107380398   1.2419144862  -0.2063450195
C   -2.1753563640   0.4485088502  -0.5616701958
C    0.2943042082   0.3365720035  -0.1228612480
C    0.9442498460  -0.1375798558  -1.2580809773
C    0.7609599332  -0.1123027534   1.1089640388
C   -2.0054998778  -1.9516483694   0.1352636844
C   -2.9374484731  -0.5996724093   1.5754935364
C   -1.3287337226   3.2847322100   0.9405912682
C    2.0120568464  -1.0185277185  -1.1896998864
C    1.8234510667  -0.9933375720   1.2118290750
C    2.4398144904  -1.4415213024   0.0564338079
C   -2.3402218927  -2.6190205885   1.2761471805
C   -0.1032596045   4.0326565306   0.5213765525
C   -0.0491814365   4.8194606642  -0.5455736105
H   -0.7580744851   1.9721341321  -1.0103189097
H   -3.0374147710   1.1166138278  -0.5381733208
H   -2.1074600298   0.0606135953  -1.5768913016
H    0.2874506214   0.2327371120   2.0169952262
H   -1.5406906231  -2.2764874386  -0.7811522379
H   -3.3332706746   0.3153906672   1.9877299510
H   -2.1653548592   3.5107171893   0.2678556985
H   -1.6322662781   3.5904146668   1.9444068959
H    2.4981122947  -1.3638002967  -2.0914663040
H    2.1611724954  -1.3235676801   2.1843486045
H   -2.1959639489  -3.6656592667   1.4965898633
H    0.7756668925   3.9038035190   1.1466956728
H    0.8526912524   5.3568125952  -0.8106303424
H   -0.9072659577   4.9640394108  -1.1927018521
*