! 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  -0.2291871655  -1.3431581624   2.0167141292
Cl   1.2544863550  -5.3486650998  -1.1692277218
O   -0.8671595931   0.8356323993   0.1788145422
O    0.3891502788   1.2310337616  -1.6429224564
N    1.2962955624   2.5699093204   0.7008889788
N    0.6483809623   2.9833446426   1.7945016014
N    1.0406074657   4.7102691495   0.4146025942
C    0.3763237361   0.5815393626  -0.4001178452
C   -1.6111036081   1.7291797400  -0.6441350502
C   -0.9535619361   1.5182445820  -1.9945454925
C   -3.0898798014   1.4057958183  -0.6188446261
C    1.5224630851   1.1746406652   0.4337631867
C    0.5809315882  -0.9210027269  -0.5628204152
C   -3.8295868912   1.8388627479   0.6432489821
C    0.3310327242  -1.8398635430   0.4558627558
C    1.0684590325  -1.4202764869  -1.7663608298
C   -3.3804324964   1.1574632278   1.9285727803
C    0.5337002724  -3.2002570279   0.2777821738
C    1.2813845380  -2.7733375658  -1.9708901775
C    1.5087165963   3.6062663023  -0.1134419686
C    1.0045836951  -3.6543780665  -0.9415762289
C    0.5228807608   4.2657519628   1.5762770719
H   -1.4560744265   2.7630751488  -0.3046113203
H   -1.4085963308   0.6819726341  -2.5390599552
H   -0.9708491094   2.4026952093  -2.6291797445
H   -3.2223965150   0.3344026872  -0.7946634064
H   -3.5425142871   1.9171406228  -1.4736768505
H    2.4626250267   1.0619766319  -0.1055323299
H    1.6240731163   0.6601751616   1.3859322392
H   -4.8940447599   1.6448211448   0.4900583794
H   -3.7377902100   2.9235016236   0.7541961937
H    1.2880003239  -0.7392989614  -2.5757981811
H   -4.0315116674   1.4422141321   2.7567646206
H   -3.4177865027   0.0704216029   1.8385702062
H   -2.3616547663   1.4263785909   2.2027022313
H    0.3262419017  -3.8919840625   1.0821990249
H    1.6567455417  -3.1261778591  -2.9209769354
H    2.0236889893   3.5189822299  -1.0565182643
H    0.0451747837   4.9135864535   2.2944166883
*