! 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 "WATER"
end
*xyz 0 1
Cl   0.5094661564  -0.0710655463  -2.9687948491
Cl   2.0542449068  -4.2446598072  -0.0452274537
O   -1.1814825416   1.4898878183   0.9221254683
O   -1.4650221485   1.3368032570  -1.3069127170
N    1.6193281202   2.1812230283   0.5176066485
N    1.5163302520   2.7541052013   1.7197472016
N    3.3702265232   1.4934675336   1.6079265151
C   -0.5182896137   1.2201391402  -0.2793342748
C   -2.5907586648   1.4535553733   0.6937551205
C   -2.6562976480   1.8855847248  -0.7598757422
C   -3.1905867984   0.0831426207   0.9694933816
C    0.5815832303   2.2808926669  -0.4760294361
C    0.0870678241  -0.1798816895  -0.2663508439
C   -4.7145330457   0.1108758596   0.9747547179
C    0.5810839457  -0.8126242160  -1.4057139147
C    0.2425165705  -0.8459485007   0.9461047860
C   -5.3142015809  -1.2608385802   1.2408840367
C    1.1809535546  -2.0621232718  -1.3484438136
C    0.8393868506  -2.0913700033   1.0337182273
C    2.7183488435   1.4257294793   0.4747369526
C    1.3028216923  -2.6916767279  -0.1229329974
C    2.5871933051   2.3175344989   2.3286284915
H   -3.0411902023   2.1961181875   1.3559819170
H   -3.5076132522   1.4787762864  -1.3056579016
H   -2.6696164283   2.9755137057  -0.8586260579
H   -2.8360802959  -0.2660977404   1.9436389322
H   -2.8378499611  -0.6421383325   0.2287288672
H    0.1452438538   3.2779108434  -0.4289932015
H    1.0405694904   2.1685511325  -1.4567194338
H   -5.0888673130   0.4864328195   0.0180865324
H   -5.0611326302   0.8169811621   1.7348854564
H   -0.1102341090  -0.3828115514   1.8558777602
H   -4.9832291641  -1.6593668913   2.2015541510
H   -6.4037540190  -1.2213874887   1.2588840144
H   -5.0235133027  -1.9766648840   0.4699857705
H    1.5498843838  -2.5309204072  -2.2498773113
H    0.9412716003  -2.5776417655   1.9934119829
H    3.0155191484   0.8667631980  -0.3989143765
H    2.8205149918   2.6135260674   3.3391424269
*