! 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   0.3149312645  -0.2757575709   1.9830160806
Cl   2.0149025294  -4.3412790733  -0.9824584451
O   -1.2677477357   1.4315838726   0.2644701541
O   -1.1184324485   1.4140962942  -1.9533216437
N    1.5915587772   2.2571109896   0.3375611119
N    2.6914836367   1.4994271148   0.3536267850
N    2.4444634634   2.5697052001   2.3103662058
C   -0.3737856565   1.2159228957  -0.7833764091
C   -2.5838348828   1.0858090320  -0.1770883531
C   -2.4075467076   0.8878163998  -1.6891900065
C   -3.1257639500  -0.1446647619   0.5288055403
C    0.7065514756   2.3027064014  -0.7936766581
C    0.2229323928  -0.1935675039  -0.7620573341
C   -4.5560341489  -0.4812413629   0.1075296950
C    0.5423782699  -0.9095149336   0.3904722257
C    0.5097105413  -0.7996691947  -1.9833345719
C   -5.5926179402   0.5434471351   0.5493145664
C    1.0874508370  -2.1845806076   0.3279011523
C    1.0607092466  -2.0654045873  -2.0748010117
C    1.4551017844   2.8779154764   1.5099534355
C    1.3386024652  -2.7525573048  -0.9070248480
C    3.1611862398   1.7172681490   1.5535212626
H   -3.2193645037   1.9503396061   0.0305557254
H   -2.4604430301  -0.1712465266  -1.9676727617
H   -3.1348389990   1.4362515810  -2.2854995035
H   -3.0942899002   0.0118663111   1.6101398772
H   -2.4741151316  -0.9966446420   0.3132118391
H    0.2193823367   3.2776431201  -0.8066289529
H    1.3039823252   2.2144810520  -1.6997785346
H   -4.8152762159  -1.4535998522   0.5310656120
H   -4.6088229841  -0.6112776990  -0.9780792183
H    0.2925548658  -0.2715360676  -2.9011919149
H   -5.4407281662   1.5190966648   0.0858159379
H   -6.5984680866   0.2174132194   0.2829007591
H   -5.5689889789   0.6857240308   1.6312302460
H    1.3166070790  -2.7214745246   1.2376257669
H    1.2642787502  -2.5023454588  -3.0420416138
H    0.6413677381   3.5517190788   1.7254238743
H    4.0724664844   1.2507998761   1.8934909966
*