! 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  -0.1996757525  -0.4980205441  -2.1025209453
Cl   4.0382132915  -2.2451484225   0.6394408121
O   -0.5585825382   2.5793521554   0.9596697743
N   -2.3286958132  -0.5845888273   0.6001238589
N   -3.2752889277  -2.0610975314  -0.7378565497
C   -0.8004263740   1.3380846702   0.3408920642
C   -1.9521299851   0.7044711635   1.1268571039
C    0.4266516175   0.4540509029   0.3666496626
C    0.7655499119  -0.4113483777  -0.6675699470
C    1.2412035681   0.4496865729   1.4962450988
C   -1.7602504191  -1.7946174952   0.8938888271
C   -3.2140689600  -0.8013662390  -0.3970272047
C    0.2324841775   3.4635031765   0.1955110800
C    1.8739872865  -1.2426852094  -0.5998573918
C    2.3502999595  -0.3706587408   1.5977705854
C    2.6567180839  -1.2112496951   0.5397125922
C   -2.3615459420  -2.6905798701   0.0621028755
C   -0.5139762792   4.1793719801  -0.8844854633
C   -1.8276548084   4.1762153812  -1.0695449578
H   -1.1284116098   1.4842983240  -0.6947819580
H   -1.6755966695   0.5907314164   2.1756335516
H   -2.8221723750   1.3604744280   1.0873854256
H    1.0067992172   1.1068023101   2.3234590179
H   -1.0110739633  -1.9118808706   1.6589687461
H   -3.8009675385  -0.0017412134  -0.8228375490
H    0.6476127568   4.1970426141   0.8923457182
H    1.0977369441   2.9487204654  -0.2418659753
H    2.1161336039  -1.9020948882  -1.4214769312
H    2.9632791186  -0.3511687162   2.4876575518
H   -2.1890160026  -3.7535696347   0.0050814916
H    0.1192587710   4.7575426697  -1.5504485341
H   -2.2740255847   4.7357564052  -1.8807008908
H   -2.5113880756   3.6264575851  -0.4339611981
*
