! 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   5.2868556363  -0.1163706856   0.3510507342
Cl   3.6925949247   0.7233983911  -1.8657791461
Cl   3.6174149331   2.2123060211   0.5977908929
Cl  -4.1241982860   1.6256580124  -0.9030247039
Cl  -5.0709530214  -1.0581586823  -0.4312877089
Cl  -4.3098470621   0.6014086774   1.7824754763
O    3.1397151796  -2.9195327931   1.5329573871
O   -1.4358494935  -2.8700056809  -0.8105529143
N    1.3150373207   0.2962361797   0.5889862784
N   -1.5605242220   0.6093867816   0.5544194341
N    2.6416620444  -1.5751052660  -0.2401372170
N   -2.2329687340  -0.7974883207  -1.3195723059
C   -0.8387651018   0.2157492398   1.7510466809
C    0.4539184788  -0.5158697961   1.4447638425
C   -0.6930870458   1.3429326661  -0.3467413376
C    0.6302121517   0.6490701846  -0.6484293912
C    2.6062249098  -0.3180343711   0.4706554727
C   -2.4781557884  -0.3558730316   0.0246636309
C    3.7222909451   0.5994678510  -0.0925138010
C   -3.9322330682   0.1841396377   0.1098728346
C    2.8683977867  -2.7593499748   0.3567698964
C   -1.7278968857  -2.0075233320  -1.6188098592
H   -1.4695175024  -0.4172922597   2.3748295091
H   -0.6222987001   1.1119633410   2.3387346831
H   -1.1955944143   1.5652183320  -1.2867248935
H   -0.4786596428   2.3125888580   0.1106985783
H    0.2195203605  -1.4901058036   0.9896139312
H    0.9736729840  -0.7161191749   2.3841483607
H    1.2267714037   1.3578112110  -1.2197672258
H    0.4584759846  -0.2251523092  -1.2922716209
H    2.9290714206  -0.5323006912   1.4907768901
H   -2.4771032045  -1.2473865173   0.6562000845
H    2.3889275338  -1.5994953778  -1.2165107625
H   -2.4059470388  -0.1701949993  -2.0914796891
H    2.7835943151  -3.5946212066  -0.3501355025
H   -1.6016364159  -2.1406666854  -2.7006685315
*
