! 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   0.0571439440  -1.8496293257  -1.7731648215
Cl   4.7401559059   0.2415406716  -0.3310146714
O   -1.8201942717  -1.2112933597   0.3859747116
O   -1.6027962529   0.6243707353   1.6027080900
N   -1.3515642863   2.1721140210  -0.8798158627
N   -0.3897803839   2.4226841670  -1.7737045449
N   -0.6942422179   4.1941565694  -0.4302959514
C   -1.2639858357   0.0604034035   0.3657545035
C   -1.6413498290  -1.7134949337   1.7068848260
C   -1.5450879622  -0.4309370655   2.5549693478
C   -2.7976605025  -2.6168832512   2.0779178762
C   -1.9387419520   0.8642427420  -0.7478838581
C    0.2552608200   0.0415269665   0.1935294441
C   -3.0076725389  -3.8037782659   1.1428880405
C    0.9137974900  -0.7573073127  -0.7379243754
C    1.0353529327   0.9141545494   0.9470052156
C   -1.7942335791  -4.7134881795   1.0038820941
C    2.2900885107  -0.7066658317  -0.9026877631
C    2.4093622163   0.9905331729   0.8016620907
C   -1.5103622873   3.2303336899  -0.0819149261
C    3.0257785248   0.1713301889  -0.1266993602
C   -0.0350528754   3.6421732703  -1.4671741963
H   -0.6967917170  -2.2661740310   1.7604409167
H   -2.3816504728  -0.3150516140   3.2455963924
H   -0.6150760349  -0.3962660475   3.1278809345
H   -3.7134448110  -2.0201948881   2.1281286860
H   -2.6100570212  -2.9789110013   3.0930859568
H   -3.0023126423   0.9639334819  -0.5312825479
H   -1.8357724055   0.3523114500  -1.7019191522
H   -3.3107921794  -3.4480217128   0.1555173468
H   -3.8510150834  -4.3852320990   1.5231017937
H    0.5615693807   1.5614739110   1.6714184132
H   -1.4332141648  -5.0496837478   1.9780964430
H   -2.0398767750  -5.6018033941   0.4210941483
H   -0.9661243308  -4.2156649969   0.4967370859
H    2.7764700813  -1.3411536003  -1.6304259197
H    2.9822189904   1.6804403500   1.4048699334
H   -2.2350678366   3.2644033354   0.7152112744
H    0.7324193639   4.1604610737  -2.0198604142
*