! 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   2.3085070868  -0.6563272599  -1.9788719141
Cl   0.3407626937  -5.3218133684  -0.3283574823
O   -0.8813763388   1.1274377274   0.6806742137
O    0.2469745094   1.3423280651  -1.2301931613
N    1.4361103413   2.6257438907   1.0472496453
N    0.9790685864   3.1175119309   2.2014253875
N    1.4212404172   4.7797725423   0.7609128384
C    0.2785428409   0.7193964340   0.0176050601
C   -1.8484755000   1.5658007626  -0.2788706012
C   -1.1160303282   1.3889240369  -1.6073367656
C   -3.1389053353   0.7787290051  -0.1972089520
C    1.4978641427   1.2092229568   0.7996548675
C    0.3179170653  -0.8057771801  -0.1042494737
C   -3.8648056159   0.8981206079   1.1352787167
C    1.1798388862  -1.4876864833  -0.9615101769
C   -0.5180931947  -1.5773773347   0.6979555158
C   -5.1584282513   0.0989672893   1.1505930074
C    1.1930597767  -2.8730378357  -1.0377625778
C   -0.5271004154  -2.9602550261   0.6442772117
C    1.6822380801   3.6246512879   0.1996156323
C    0.3317741239  -3.5972428680  -0.2332097474
C    0.9953223690   4.4045804565   1.9809567618
H   -2.0489720740   2.6243964197  -0.0829718973
H   -1.4159712677   0.4622601946  -2.1124112766
H   -1.2644865096   2.2208799038  -2.2939173904
H   -2.9414875021  -0.2744526455  -0.4242303939
H   -3.7900969290   1.1452855456  -0.9981272488
H    2.4137549167   0.9805794045   0.2572177894
H    1.5526441336   0.7020730664   1.7608189673
H   -4.0782872805   1.9510548660   1.3409630451
H   -3.2170365535   0.5524858934   1.9451646964
H   -1.1886669977  -1.0898577774   1.3906281296
H   -5.6801664513   0.2000836321   2.1029964506
H   -5.8402018340   0.4299276031   0.3647815160
H   -4.9676160714  -0.9641349084   0.9924241025
H    1.8678824245  -3.3751284454  -1.7167076408
H   -1.1964886636  -3.5234934666   1.2789018048
H    2.0691646408   3.4736241499  -0.7947173922
H    0.6884194264   5.1083585080   2.7386099288
*