! 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   1.6136229216   1.7812967750   1.9541602129
Cl   4.4574918152  -0.5267781824  -1.9141806242
O   -1.8106766312  -0.6472901826   0.3150090176
O   -0.8731446810   0.2031051143   2.1583673697
N   -1.3449001144   1.9275049264  -1.0338887424
N   -0.3071082354   2.5827391693  -1.5625629229
N   -1.5881239567   1.7036984574  -3.1818998470
C   -0.9013705064   0.3099724628   0.7608797236
C   -1.7327991666  -1.7499312337   1.2160043507
C   -1.4255590785  -1.0510125466   2.5374725166
C   -3.0300204107  -2.5264744798   1.1914583739
C   -1.4437569971   1.6944621200   0.3848864965
C    0.4777616633   0.0757494697   0.1447465461
C   -3.0055697146  -3.7142886966   2.1468646292
C    1.6350308541   0.7022847288   0.6003730485
C    0.5957593517  -0.7316126894  -0.9827089383
C   -4.3022122527  -4.5072422906   2.1058638835
C    2.8612280238   0.5197092842  -0.0205910088
C    1.8055919615  -0.9315342294  -1.6253358065
C   -2.0868014566   1.3993566604  -2.0089141140
C    2.9330603535  -0.3006330914  -1.1321957799
C   -0.5015066910   2.4239393312  -2.8444516420
H   -0.9015844906  -2.4067989873   0.9283632058
H   -2.3315209799  -0.8821254314   3.1280670732
H   -0.7118176138  -1.6069076864   3.1467769499
H   -3.2148610756  -2.8844862360   0.1748949853
H   -3.8552765365  -1.8564154041   1.4526390477
H   -0.8863997391   2.4783843504   0.8908924502
H   -2.4865935981   1.7688892732   0.6929816650
H   -2.8278109713  -3.3686638576   3.1695228953
H   -2.1663426913  -4.3686235466   1.8948856551
H   -0.2802009090  -1.2231106589  -1.3819566456
H   -5.1548562980  -3.8862071685   2.3859207879
H   -4.4954601354  -4.9001638744   1.1061602982
H   -4.2721380601  -5.3534901158   2.7926250135
H    3.7432749254   1.0178304284   0.3567088203
H    1.8585376204  -1.5677112703  -2.4974236815
H   -2.9815981210   0.8267095451  -1.8255087090
H    0.1683075421   2.8533423310  -3.5727779084
*