! 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  -0.0513803128  -0.8230955240  -2.4805678085
Cl   4.5735987854  -1.6310615247   0.0359190739
O   -2.1041041043  -0.7899378272  -0.3692843309
O   -1.5986861476   0.0942108492   1.6361347645
N   -0.3406605567   2.3642422576   0.2059287839
N    0.8113681745   2.5730320288  -0.4391117877
N    0.8761609115   3.5031068800   1.6016606663
C   -1.2130258304   0.0660225355   0.2906502832
C   -3.1516229635  -1.1785223074   0.5230904499
C   -2.9838015812  -0.2008185721   1.6727578711
C   -1.3455558518   1.4769100787  -0.3206377388
C    0.2231020585  -0.4216624114   0.2101926843
C   -4.4975166797  -1.1064701263  -0.1634604345
C   -4.6325167794  -2.0628941444  -1.3376625694
C    0.8203777472  -0.8130290937  -0.9855912375
C    1.0245628205  -0.4051059464   1.3480911948
C    2.1519369378  -1.1944910341  -1.0471773688
C    2.3591873494  -0.7702424459   1.3131727006
C   -0.2788699906   2.9103341504   1.4221155883
C    2.9108144851  -1.1672463663   0.1089269362
C    1.5002202902   3.2595058267   0.4333392869
H   -2.9634563214  -2.2039463423   0.8636944631
H   -3.5884030271   0.7026836099   1.5278677192
H   -3.2266303640  -0.6269276271   2.6443855782
H   -2.3345790628   1.8828034021  -0.1027988000
H   -1.2352365702   1.4485712728  -1.4014887184
H   -4.6836730120  -0.0783344609  -0.4873297034
H   -5.2587812095  -1.3371094370   0.5868820163
H   -4.4836856828  -3.0981511988  -1.0259895409
H   -5.6261887482  -1.9932721932  -1.7802968034
H   -3.9079420945  -1.8436309169  -2.1221642200
H    0.6083608064  -0.0954363737   2.2953571389
H    2.5884400665  -1.5001219673  -1.9876129804
H    2.9529075046  -0.7415449744   2.2158065406
H   -1.0927428300   2.8752346649   2.1280398018
H    2.4972573623   3.6080787742   0.2144861426
*