! 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  -6.0033519479   1.7198060924  -2.0170503168
O    3.0525091145   1.5599017013  -0.2263021428
O    1.5356898459  -1.2462203556   2.4032451410
N    2.3277651888  -0.4922393955   0.4161089333
N    1.6312979366  -2.7200168703   0.6797593556
N    0.5095231429  -4.4972989237   0.0280523381
C    2.6112013377   0.8775329297   0.9286819451
C    2.6396570110  -0.5915853682  -1.0332000002
C    2.5982286413   0.8942185724  -1.3809358052
C    1.3769117352   1.5689862731   1.5223417184
C    3.7612631975   0.8829078336   1.9229721662
C    4.0396880393  -1.1487316228  -1.2673893861
C    1.6074994573  -1.3227369149  -1.8787374243
C    0.1062294063   1.5276380201   0.6840769635
C    1.8372245821  -1.4186778408   1.2385797018
C   -1.0901962948   2.1073263032   1.4417449736
C   -2.3430344798   2.0345100794   0.6172683067
C    2.5637359898  -3.7029103357   0.4623469876
C    0.4143811594  -3.2568916794   0.4163464308
C   -2.7541131824   3.1084206053  -0.1670063919
C   -3.0928422451   0.8612292276   0.5694291808
C    1.8475337753  -4.7863469798   0.0551018081
C   -3.8770926242   3.0227843930  -0.9778545503
C   -4.2175507107   0.7540250037  -0.2344706456
C   -4.5989111232   1.8408759662  -1.0052758273
H    3.2630310829   1.1342751175  -2.2112141234
H    1.5846777428   1.2035204258  -1.6595637007
H    1.6652870227   2.6108777195   1.6899682939
H    1.1750120488   1.1539353913   2.5091452410
H    4.6426344125   0.3959197707   1.5055175615
H    3.4972472923   0.3822053713   2.8512803158
H    4.0259089122   1.9120164946   2.1686704695
H    4.2736647170  -1.1083484133  -2.3317458037
H    4.1239567486  -2.1886258301  -0.9589901588
H    4.7999670785  -0.5745810606  -0.7376935943
H    1.7171515522  -2.4048941793  -1.8582078539
H    0.5873721728  -1.0577344540  -1.5992780349
H    1.7470466576  -1.0152824917  -2.9166638488
H    0.2376725130   2.0900883192  -0.2430497936
H   -0.1357082749   0.5006455678   0.3931827105
H   -0.8825725021   3.1442486170   1.7164715299
H   -1.2279219961   1.5551571130   2.3750729141
H    3.6143485080  -3.5593353946   0.6466652839
H   -0.4989882127  -2.6910542599   0.5163357897
H   -2.1924478657   4.0344838000  -0.1486712356
H   -2.8000458334   0.0098957314   1.1724860702
H    2.2279958426  -5.7606342897  -0.2062133343
H   -4.1808629807   3.8697501811  -1.5778223007
H   -4.7861736551  -0.1656992809  -0.2551413581
*