! 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  -0.5713011940  -0.6106966310   2.5380743181
Cl   2.1323726406  -4.0137465889  -0.5383657300
O   -1.7563055030   1.3803777778   0.7315218530
O   -0.7446056206   1.9499238275  -1.1648167626
N    1.7806833148   2.2090663910   0.4010155623
N    2.6668335528   1.3912196227   0.9768003807
N    3.5101170376   2.2553644888  -0.9144987475
C   -0.5142908441   1.3856843985   0.0939076191
C   -2.7831846413   1.3088887601  -0.2590173152
C   -2.0139725896   1.4677582807  -1.5762233383
C   -3.5755881049   0.0201516082  -0.1623620983
C    0.4257851097   2.3065488116   0.8796264941
C    0.0856149967  -0.0132917115  -0.0483737340
C   -4.7418703810   0.0028664483  -1.1441621499
C    0.1199781419  -0.9434161348   0.9870212427
C    0.7234562396  -0.3613522635  -1.2357851957
C   -5.5644461358  -1.2720394550  -1.0473659589
C    0.7379600744  -2.1766979278   0.8435706215
C    1.3561153813  -1.5801959141  -1.4055226446
C    2.2921128310   2.7013459218  -0.7291393687
C    1.3523013236  -2.4823710530  -0.3573607089
C    3.6811848570   1.4567134548   0.1564300187
H   -3.4509762932   2.1606044647  -0.0959804362
H   -1.9188677639   0.5128992188  -2.1073226338
H   -2.4582504742   2.1950925121  -2.2531485386
H   -3.9587280803  -0.0901910935   0.8556492233
H   -2.9159196622  -0.8339839339  -0.3482797008
H    0.4238916308   2.0419628732   1.9343050549
H    0.0811690278   3.3367658641   0.7897536968
H   -4.3733669782   0.1156312207  -2.1683784785
H   -5.3840011730   0.8680782217  -0.9557428243
H    0.7370842228   0.3377407230  -2.0601086675
H   -5.9650879774  -1.4094839738  -0.0415608232
H   -6.4081376454  -1.2528689740  -1.7377775416
H   -4.9637592480  -2.1512719730  -1.2856707351
H    0.7456468371  -2.8815924647   1.6631414913
H    1.8427244213  -1.8141137735  -2.3417103177
H    1.7598292080   3.3883666726  -1.3671354367
H    4.5917111206   0.9096115274   0.3429223051
*