! 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  -0.6034309313  -0.2628343390  -2.3804596747
Cl  -5.3439913795  -0.8429320677   0.0631745755
O    0.8551579712  -2.1046919468   0.1835805035
N    1.4214824531  -0.8712034630   0.3242403783
N    4.5208983483   1.9355748095   1.7896119365
C    1.0161843131   1.4856244198   0.5154484906
C    0.5625257686   0.0627969983   0.3756606179
C   -0.8990234481  -0.1678751413   0.2970614573
C    2.5040996504   1.6498542920   0.5197725889
C   -1.5358609590  -0.3314058543  -0.9269863131
C   -1.6697575085  -0.2144891438   1.4517183112
C    3.2447154929   1.6039558840  -0.6548822986
C    3.2000382521   1.8206467702   1.7081521844
C   -2.9020856239  -0.5364278604  -1.0169320548
C   -3.0379482942  -0.4228815343   1.3941038144
C   -3.6380366370  -0.5826085426   0.1562027610
C    4.6218519457   1.7242996016  -0.5872182361
C    5.2119447226   1.8825850179   0.6574860400
C    1.8620793087  -3.0844354752   0.0190155848
H    0.5694756858   2.0617061167  -0.3009890060
H    0.5831024578   1.8960505724   1.4328756717
H   -1.1939689519  -0.0892792930   2.4154744077
H    2.7498713968   1.4745509737  -1.6097083225
H    2.6558133020   1.8678985581   2.6457437379
H   -3.3792601991  -0.6609555621  -1.9787590913
H   -3.6210461292  -0.4615755724   2.3030115188
H    5.2328154289   1.6934117167  -1.4784589181
H    6.2883678360   1.9723215203   0.7416857197
H    1.3426448045  -4.0348828466  -0.0781169545
H    2.5294630187  -3.1337303782   0.8813625035
H    2.4541761899  -2.9130584978  -0.8824756661
*
