! 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   0.0023830791  -1.7207884524  -1.8607381041
Cl   4.7241012988   0.2650853997  -0.3989303619
O   -1.8252686721  -1.1734759582   0.3779681157
O   -1.5928418800   0.6473338505   1.6264381346
N   -1.3520187836   2.2226763738  -0.8500441127
N   -0.4117669052   2.4612093944  -1.7691611612
N   -0.6296308711   4.2207044548  -0.3938807199
C   -1.2710629902   0.0992120537   0.3755943056
C   -1.6176400251  -1.6904789816   1.6882473519
C   -1.6740207918  -0.4266605874   2.5577199743
C   -2.6729717919  -2.7232548474   2.0114086584
C   -1.9598869078   0.9238723090  -0.7147975241
C    0.2458550186   0.0796567053   0.1849730865
C   -2.6668833913  -3.9445357937   1.0962012097
C    0.8835553567  -0.6810097334  -0.7924842313
C    1.0450675654   0.9059524795   0.9690972025
C   -1.3633699416  -4.7299281085   1.1179023458
C    2.2571760567  -0.6345213570  -0.9760239508
C    2.4180752416   0.9762618674   0.8067581878
C   -1.4592121647   3.2726202811  -0.0336832602
C    3.0125231108   0.1989643954  -0.1702709799
C   -0.0167612537   3.6665541199  -1.4571114271
H   -0.6183135636  -2.1375912526   1.7496316346
H   -2.6146153367  -0.3384010906   3.1058880253
H   -0.8504751835  -0.3898850853   3.2737268354
H   -3.6564450423  -2.2446355834   1.9873454295
H   -2.5105032604  -3.0428548789   3.0453295501
H   -3.0152622367   1.0394290812  -0.4686348910
H   -1.8903086405   0.4216766467  -1.6766877189
H   -2.8951568591  -3.6417794817   0.0715175528
H   -3.4856446761  -4.5986699196   1.4050544858
H    0.5888715898   1.5202236616   1.7322538165
H   -1.0804031972  -5.0039059782   2.1363779406
H   -1.4557107478  -5.6526093221   0.5439661150
H   -0.5363378787  -4.1656619537   0.6841860632
H    2.7264154717  -1.2383615365  -1.7400806923
H    3.0067549072   1.6297713813   1.4347718769
H   -2.1575582212   3.3134596108   0.7864201694
H    0.7455011223   4.1742029680  -2.0268160399
*