! 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   0.8448345668   0.0190676986  -2.9617853838
Cl   1.9926014943  -4.1591785327   0.1354115766
O   -1.3125160042   1.5740471652   0.6803574805
O   -1.2724520618   1.5091331347  -1.5465292777
N    1.5859634719   2.1829063989   0.6085953454
N    2.7072959908   1.4859923885   0.3991553504
N    2.4452597634   1.9121654258   2.5864202948
C   -0.4737980313   1.3352271081  -0.4178477372
C   -2.6694400161   1.3303237201   0.2918057688
C   -2.5438876723   0.9948457053  -1.1966402886
C   -3.3179582228   0.2315113343   1.1105490109
C    0.6287460069   2.4003972922  -0.4447101747
C    0.1208809762  -0.0703198902  -0.3247150607
C   -4.7859519689   0.0518694183   0.7382917588
C    0.7288865925  -0.7163659652  -1.3983355762
C    0.1404860402  -0.7251137970   0.9032340534
C   -5.4525397624  -1.0627533735   1.5287210137
C    1.2983168243  -1.9742814693  -1.2692616810
C    0.7119213128  -1.9750357461   1.0658726736
C    1.4383242523   2.4139180391   1.9149380732
C    1.2814009772  -2.5932549306  -0.0322150278
C    3.1844856252   1.3547984287   1.6081055805
H   -3.2219161045   2.2647817897   0.4326759006
H   -2.5897525277  -0.0876653796  -1.3698900556
H   -3.2976563077   1.4766134665  -1.8164973512
H   -3.2395820718   0.4729786663   2.1742120324
H   -2.7810786489  -0.7100734432   0.9562616426
H    0.1820706848   3.3879989639  -0.3322883948
H    1.1617961350   2.3779167743  -1.3922127719
H   -4.8770700021  -0.1648338481  -0.3304701984
H   -5.3200297366   0.9917622931   0.9044802753
H   -0.2990043909  -0.2482497473   1.7673331441
H   -6.5045105642  -1.1637157891   1.2599998273
H   -4.9712128382  -2.0239127244   1.3402104544
H   -5.4029984700  -0.8742008602   2.6025639952
H    1.7532977239  -2.4573441661  -2.1225507049
H    0.7082317759  -2.4522030095   2.0356730130
H    0.6063957983   2.9626733096   2.3258760224
H    4.1128081547   0.8378025706   1.7932358081
*
