! 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  -0.4606704822   1.0878475372  -2.3903009001
Cl   3.7320346631   2.5629426700   0.5406207570
O   -2.4443691856   0.0055487663  -0.4541889455
O   -1.7014328511  -1.1335665163   1.3388586769
N    0.1242353237  -2.5798952181  -0.5334489952
N    0.2122046297  -3.4083286969   0.5104020054
N    2.2407260446  -3.0556219864  -0.3853267153
C   -1.3453584545  -0.6889780035   0.0579621492
C   -3.2990301022   0.3657235037   0.6298560687
C   -3.0546089985  -0.7826265652   1.5923338913
C   -1.0949179685  -1.8928098441  -0.8692848353
C   -0.0925052855   0.1783707910   0.1672567138
C   -2.9772161127   1.7359325991   1.2038033335
C   -3.0435157796   2.8487989678   0.1713758835
C    0.3708142399   0.9809506834  -0.8733062051
C    0.6853159036   0.1276695114   1.3211819316
C    1.5389114713   1.7215203541  -0.7665931552
C    1.8581228887   0.8501922779   1.4536898234
C    1.3393925104  -2.3705786283  -1.0427302753
C    2.2732159209   1.6482146278   0.4029919247
C    1.4929117703  -3.6655193528   0.5528406417
H   -4.3209492331   0.3580325087   0.2446898313
H   -3.1567444524  -0.5008134360   2.6406496790
H   -3.7182310297  -1.6288551136   1.3914489380
H   -1.0211729874  -1.5673855655  -1.9053199136
H   -1.9307781697  -2.5886466230  -0.8021000297
H   -3.7035704001   1.9276730414   1.9981323783
H   -1.9953617504   1.7275638720   1.6861077858
H   -4.0297661456   2.9015343940  -0.2928010790
H   -2.8472941139   3.8166621228   0.6320529728
H   -2.3107337278   2.7094805478  -0.6226256118
H    0.3730891748  -0.4915918711   2.1487659688
H    1.8693639567   2.3399963535  -1.5893201557
H    2.4351620890   0.7843053439   2.3651375610
H    1.5162074339  -1.7373127542  -1.8978027531
H    1.9076783755  -4.3334082997   1.2912613667
*
