! 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  -0.0428153698  -0.5248594449  -2.7229422294
Cl   4.3578236825  -0.7054474007   0.2693663967
O   -2.2371935911  -1.3672172189  -0.9397418366
O   -2.2286514741  -0.7777529279   1.2175716396
N   -1.4406935707   1.9642616630   0.3399233369
N   -1.7458504053   2.2231887991   1.6142792250
N    0.0980757560   3.3491822119   1.0033047459
C   -1.6812214862  -0.4598283102  -0.0266744647
C   -2.1275784467   0.9534266319  -0.4204397101
C   -0.1545450477  -0.5606733105   0.0110439592
C   -2.7607236048  -2.4820722761  -0.2236934180
C   -2.3963303022  -2.1885972599   1.2229861570
C    0.6405028372  -0.5918105374  -1.1327490484
C    0.5030941637  -0.5420987411   1.2383125380
C    2.0250590410  -0.6394208063  -1.0642235991
C    1.8828630813  -0.5874463249   1.3382241606
C   -0.3342266995   2.6266727546   0.0001230535
C    2.6337966085  -0.6425843814   0.1776649428
C   -0.8010830203   3.0567567640   1.9610171021
H   -3.2020157541   1.0543390602  -0.2708074513
H   -1.9212457065   1.1297479285  -1.4744390378
H   -2.3130903329  -3.4085186362  -0.5849117491
H   -3.8407942913  -2.5310829116  -0.3750029039
H   -3.1827664284  -2.4438751674   1.9305015903
H   -1.4747034898  -2.6961187808   1.5244325681
H   -0.0717317133  -0.4921868892   2.1521288378
H    2.6152217465  -0.6679833323  -1.9694376563
H    2.3571873078  -0.5768959603   2.3092368377
H    0.1023637227   2.5740311873  -0.9850836578
H   -0.7646668477   3.4838205845   2.9508687694
*