! 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  -0.2538760238  -1.1380447139   2.1425746208
Cl   0.9530194275  -5.3058384387  -0.9450389317
O   -0.7230357692   1.0654276152   0.2792225343
O    0.4962335569   1.3036775451  -1.5807523334
N    1.5758037405   2.6472742161   0.6627096138
N    2.2296614341   3.5035138216  -0.1274849937
N    0.8876336673   4.6103541374   1.2914507325
C    0.4778933980   0.6911506872  -0.3264368853
C   -1.5995461838   1.6408813036  -0.6885830416
C   -0.8543627136   1.4127112786  -1.9967383053
C   -2.9682513972   0.9985071682  -0.6317367456
C    1.6615893918   1.2219641606   0.4870546207
C    0.5752421048  -0.8286209916  -0.4498837610
C   -3.6723267063   1.1785593649   0.7067710047
C    0.2651760104  -1.7040639355   0.5901728952
C    1.0260254351  -1.3905622915  -1.6405214242
C   -5.0579331651   0.5518578687   0.7167671313
C    0.3798551209  -3.0789126890   0.4472446636
C    1.1455312710  -2.7591420453  -1.8130506072
C    0.7747534600   3.3200772550   1.4898305141
C    0.8159317792  -3.5937584032  -0.7606607129
C    1.7878188998   4.6595226149   0.2910221490
H   -1.6846727689   2.7141573743  -0.4779238211
H   -1.1892743801   0.4974578050  -2.4997454645
H   -0.9420220457   2.2439107595  -2.6941099340
H   -2.8780786261  -0.0670955347  -0.8671439885
H   -3.5753847597   1.4422754854  -1.4277009560
H    2.5996657194   0.9904146706  -0.0137549449
H    1.6883358240   0.7473942141   1.4663826924
H   -3.7501909362   2.2454387570   0.9364693937
H   -3.0660356834   0.7343165270   1.4997708278
H    1.2920338195  -0.7460909200  -2.4664106848
H   -5.6988717660   0.9881906372  -0.0517486647
H   -5.0080498578  -0.5227056547   0.5308133021
H   -5.5534427933   0.6947535782   1.6777921283
H    0.1312202091  -3.7348978322   1.2697769690
H    1.4924064900  -3.1599157849  -2.7549776382
H    0.1521125702   2.8404508099   2.2271347278
H    2.1376480548   5.5846615332  -0.1393381597
*