! 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  -5.3826952988  -0.7042874997  -0.1266475611
O    3.1104115395   0.0734117635  -1.1168251401
O    0.4479074371  -0.3930884500  -0.6022686928
N    1.1985825571   1.6493096679   0.2051477851
N    1.2244197498   2.4525738877   1.2723902663
N    1.1734025809   3.6543945937  -0.6202426085
C    2.9457038918  -1.7780231136   0.5040359780
C    2.7016827465  -0.2839658718   0.1817873505
C    1.2657540667   0.2037934499   0.3546840509
C    4.4645572671  -1.9737162857   0.5806219431
C    2.3463582459  -2.1185499902   1.8688266926
C    2.3907563512  -2.7303547861  -0.5550895087
C    1.1750595182   2.3761024856  -0.9135317893
C   -0.9012105887  -0.4083223125  -0.4247889085
C    1.2084518923   3.6399844939   0.7256927326
C   -1.6181907552  -1.1450447957  -1.3633840780
C   -1.5712666369   0.2422343952   0.6039567687
C   -2.9944671505  -1.2375810260  -1.2748832185
C   -2.9543909207   0.1462125427   0.6925922045
C   -3.6576491208  -0.5898808044  -0.2423649813
H    3.2677166213   0.2859388124   0.9329707050
H    0.9351138196  -0.0064573019   1.3750929599
H    4.7017018216  -3.0023635166   0.8567484587
H    4.9565220598  -1.7813261488  -0.3747271242
H    4.9176839438  -1.3201393687   1.3293168741
H    1.2550257721  -2.1450103900   1.8519587344
H    2.6536562124  -1.4081096209   2.6402110278
H    2.6790793997  -3.1069506880   2.1901468206
H    2.7557622619  -2.4860105333  -1.5526972915
H    1.3026684296  -2.7430969355  -0.5876290887
H    2.7160588843  -3.7489349417  -0.3343101125
H    4.0624145036   0.2030836260  -1.1145008315
H    1.1436731535   1.9561148938  -1.9049012984
H    1.2190097327   4.5363125161   1.3251198303
H   -1.0955122282  -1.6513550176  -2.1643524780
H   -1.0594682507   0.8340583352   1.3497502326
H   -3.5411977377  -1.8149525868  -2.0075000544
H   -3.4683571536   0.6556983089   1.4958320700
*