! 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  -0.6396188422  -0.8357560303  -2.4053015077
Cl  -5.3344382932  -0.7709283757   0.1761509242
O    0.8616912345  -2.0464653261   0.2002685310
N    1.4369621540  -0.8100522172   0.2187021534
N    4.3391974333   2.1601850805   1.9295908069
C    1.0524351324   1.5560234705   0.2188823758
C    0.5824823668   0.1306485801   0.2066797762
C   -0.8820260179  -0.0915398537   0.1785996933
C    2.5280381716   1.7181388160   0.4156298786
C   -1.5381538581  -0.5450772793  -0.9604929926
C   -1.6408463189   0.1626415761   1.3151204635
C    3.4332251692   1.5585616446  -0.6259023734
C    3.0444128760   2.0190264883   1.6689847233
C   -2.9071721523  -0.7538045816  -0.9770322418
C   -3.0102810601  -0.0431174836   1.3306059266
C   -3.6276543305  -0.5040110542   0.1798553240
C    4.7865755008   1.7029666198  -0.3711039032
C    5.1889785902   2.0000203292   0.9215618752
C    1.8532698383  -3.0426948966   0.0432912058
H    0.7360781564   2.0190694105  -0.7214653102
H    0.5076493485   2.0926874921   1.0011655201
H   -1.1521817256   0.5196994224   2.2123903896
H    3.0845942640   1.3280069085  -1.6250356125
H    2.3692552082   2.1573860036   2.5074131622
H   -3.3996696689  -1.1062673907  -1.8724566322
H   -3.5807205293   0.1511039679   2.2277045999
H    5.5200577664   1.5871310951  -1.1568892778
H    6.2412899068   2.1163416835   1.1521434785
H    1.3281088799  -3.9956840343   0.0535650379
H    2.5782023792  -3.0306586018   0.8601187897
H    2.3828847392  -2.9439362497  -0.9067278351
*
