! 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   3.7811959640  -0.6919150666  -1.5555045299
Cl   3.2282360533   2.0348434465  -0.8043133306
Cl   5.4556007418   0.6499047333   0.3593715714
Cl  -3.8563092686   1.9203694594   0.5650175666
Cl  -5.2659663999  -0.3777445368  -0.3765447031
Cl  -3.7062116632  -0.5530572595   2.0326689237
O    4.1348482298  -0.3131088682   3.4965824632
O   -2.9915714613  -1.4067445425  -3.0596323536
N    1.5131405851  -0.0599582905   0.5165592262
N   -1.3094448515  -0.3631571525   0.2338436597
N    3.3991066753  -1.2049489706   1.5312812598
N   -2.5986101622   0.3779190390  -1.6959915238
C   -0.7187579784   0.9203145488   0.5881706497
C    0.5933331915   0.7232032123   1.3190973568
C   -0.3657110075  -1.1767827215  -0.5260084025
C    0.9367782688  -1.3583769530   0.2246246154
C    2.8772344785  -0.0008826066   0.9474827419
C   -2.5765692160  -0.3335457408  -0.4394629386
C    3.7917515733   0.4679624914  -0.2178191881
C   -3.7705829987   0.1503815696   0.4239789335
C    3.9942357858  -1.2544116864   2.7377905136
C   -2.7634219951  -0.2229163541  -2.8883957948
H   -1.3765505173   1.4642654289   1.2622617392
H   -0.5386896895   1.5574509904  -0.2894772200
H   -0.8044286909  -2.1620150821  -0.6944757037
H   -0.1449492410  -0.7428070916  -1.5112222021
H    0.4033259651   0.2568472113   2.2972048620
H    1.0188432686   1.7089761680   1.5077423126
H    1.5953124880  -1.9473031567  -0.4130056084
H    0.7549125032  -1.9441820469   1.1362746465
H    2.9771073997   0.7805728565   1.7028860860
H   -2.8196196336  -1.3727131823  -0.6675531309
H    3.3760276645  -2.0630160649   1.0005015718
H   -2.3768057613   1.3622214852  -1.7090745858
H    4.3441205883  -2.2664850805   2.9766714379
H   -2.6717111168   0.4888081364  -3.7188902413
*