! 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  -0.8710120131  -0.2529187666   2.0352400177
Cl  -5.0254532711   1.4332028372  -1.0080497480
O   -0.1878653423  -1.7685502071  -0.2612872346
O    2.7240427693  -0.9475938305  -2.1161070211
N    2.1226403838  -0.4805916808   0.0337799645
C    0.7593129766  -1.9945600513  -1.2992798857
C   -1.2860747640  -1.0136591843  -0.4990526165
C    1.9674189383  -1.0693636206  -1.1661666223
C    1.2006105561  -3.4453821170  -1.2375146270
C   -2.9156343835   0.5542169359   0.4398455337
C   -1.7622256504  -0.2217910221   0.5487352017
C   -1.9883558764  -1.0359909788  -1.6944760082
C    3.1383383911   0.3763762933   0.4786092045
C   -3.5791439961   0.5040550591  -0.7871611094
C   -3.1323994567  -0.2731462768  -1.8387368167
C   -3.4415310944   1.4061194456   1.5511361026
C    4.2491510400   0.7448983760  -0.2793152923
C    3.0046895948   0.8750030328   1.7764553621
C    5.1995637803   1.5961201708   0.2701225277
C    3.9604842601   1.7201799184   2.3108257271
C    5.0685646677   2.0884000048   1.5590234307
H    0.3298817226  -1.7905179739  -2.2817037169
H    1.6405890419  -3.6882350764  -0.2702413836
H    1.9387644172  -3.6466431926  -2.0115026970
H    0.3482404026  -4.1013993692  -1.4091562331
H    1.4157109196  -0.6935649944   0.7231794853
H   -1.6717437407  -1.6598244637  -2.5187717936
H   -3.6767864619  -0.2996381084  -2.7719231507
H   -4.4282953488   1.0637059294   1.8649677244
H   -3.5478458722   2.4411752281   1.2267189495
H   -2.7968591109   1.3991046400   2.4238873063
H    4.3887752580   0.3815800196  -1.2834247823
H    2.1449606799   0.5989068893   2.3755801136
H    6.0567600525   1.8729787257  -0.3293980823
H    3.8342811690   2.0909816148   3.3191438473
H    5.8181414708   2.7489207234   1.9730809387
*
