! 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  -0.0589429718  -0.5852109421  -2.7360595108
Cl   4.3869955468  -0.7064584313   0.1898774725
O   -2.2416395827  -1.3740404554  -0.8815232733
O   -2.1780709164  -0.7204916585   1.2502661728
N   -1.4591157580   1.9764188486   0.3358110755
N   -1.8943683199   2.3013878543   1.5563099796
N    0.0331451919   3.3599189225   1.1005603972
C   -1.6541808501  -0.4478460424  -0.0207056499
C   -2.0927041071   0.9545304825  -0.4564028369
C   -0.1286703765  -0.5662591251   0.0013095988
C   -2.3300763480  -2.5777929893  -0.1347393655
C   -2.6108534858  -2.0795276763   1.2779483905
C    0.6485556214  -0.6129177366  -1.1551351558
C    0.5472353304  -0.5548554197   1.2181275950
C    2.0336868014  -0.6601553970  -1.1074613156
C    1.9286801685  -0.6005144385   1.2969249567
C   -0.3077504498   2.6028158170   0.0883295785
C    2.6615623639  -0.6541900877   0.1251893246
C   -0.9740096262   3.1339113766   1.9648481469
H   -3.1742309570   1.0488880979  -0.3617009513
H   -1.8343809812   1.1252845810  -1.5004038577
H   -1.3943752159  -3.1428388984  -0.1907842976
H   -3.1314046565  -3.1888024182  -0.5461497965
H   -3.6738414646  -2.1034675099   1.5228531111
H   -2.0643463696  -2.6439791248   2.0350808656
H   -0.0146791384  -0.5064663854   2.1395986282
H    2.6096123907  -0.6978578807  -2.0213175630
H    2.4178085294  -0.5899266175   2.2605301745
H    0.2322054111   2.4966286287  -0.8399544475
H   -1.0332559840   3.6049442109   2.9334179274
*