! 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   0.6176766614  -0.1944317830   2.9809962306
Cl   4.0513294091   2.5383966271  -0.0326232407
O   -1.9911832706  -0.0872675802  -0.6924075743
O   -1.9782232856  -0.0371496541   1.5623188049
N   -0.1619681489  -2.3491899508  -0.6125857785
N   -0.7024001594  -2.6472894091  -1.7970306962
N    1.5376475895  -2.7480610528  -1.9094047025
C   -1.2204075882  -0.3825506681   0.4332927492
C   -3.3043428457   0.2821167724  -0.2778418121
C   -3.0457642152   0.7882994862   1.1257287336
C   -0.9532920641  -1.8978456642   0.5021983650
C    0.0880564361   0.3981220136   0.3587918134
C   -3.8961008899   1.2992030344  -1.2258700527
C   -4.1114153693   0.7655386512  -2.6334025410
C    0.9673633074   0.5065796208   1.4355286503
C    0.4846640577   0.9754643375  -0.8441809937
C    2.1828927516   1.1654175748   1.3263954147
C    1.6926729638   1.6372735956  -0.9824915287
C    1.1687270283  -2.4019794478  -0.7018686764
C    2.5344599168   1.7252721299   0.1113510999
C    0.3514223193  -2.8829162890  -2.5326338446
H   -3.9445305563  -0.6096950865  -0.2454925841
H   -2.7560246691   1.8458588744   1.1252269029
H   -3.8916305390   0.6555442654   1.7984135878
H   -1.9002019465  -2.4360801694   0.4998477142
H   -0.4294952557  -2.1602322484   1.4196912989
H   -4.8542147537   1.6151600769  -0.8047219968
H   -3.2576685214   2.1864834076  -1.2480960484
H   -4.5848637456   1.5187754291  -3.2630363155
H   -3.1711500572   0.4852747331  -3.1084473483
H   -4.7582095936  -0.1134856273  -2.6311212920
H   -0.1651371946   0.9085974819  -1.7041406144
H    2.8436894446   1.2347156589   2.1790702034
H    1.9678629405   2.0725784206  -1.9327180080
H    1.8232062001  -2.2064521239   0.1333712419
H    0.2609231540  -3.1725747753  -3.5677174647
*