! 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   0.3570999975   1.1516558328  -2.1971245826
Cl   3.4540227280   4.1686600009   0.9168565869
O   -1.3334090674  -0.3316399728  -0.3281844928
O   -0.5021809620  -1.1394917721   1.5991858879
N   -0.2073125081  -2.9333971767  -0.5597319749
N   -0.9517458173  -3.1096090004  -1.6554704900
N   -1.4132651167  -4.6909641819  -0.1297450822
C   -0.1468456433  -0.6506278104   0.3349483226
C   -2.4513463402  -0.6648653742   0.4888830084
C   -1.8288989828  -0.7229404069   1.8712773594
C    0.6216617942  -1.7722898116  -0.3801857598
C    0.7425008238   0.5830963692   0.4515287651
C   -3.5490084871   0.3650186652   0.3394886046
C   -4.1114263995   0.4509812210  -1.0706692500
C    1.0148067549   1.4320576262  -0.6203078822
C    1.3564628370   0.8727403521   1.6658710851
C    1.8426942196   2.5364451807  -0.4857714767
C    2.1893704059   1.9671881505   1.8280554292
C   -0.5048526718  -3.8725595023   0.3408721000
C    2.4210035466   2.7947824591   0.7445040413
C   -1.6497486864  -4.1711055724  -1.3499656683
H   -2.8350780678  -1.6528799674   0.1984401240
H   -1.8428509160   0.2573921793   2.3625661967
H   -2.2995190568  -1.4521430348   2.5287498756
H    1.4944249055  -2.0471145988   0.2114737329
H    0.9736115644  -1.4495843213  -1.3564887814
H   -4.3459159712   0.0942209707   1.0373068593
H   -3.1733813933   1.3411574641   0.6576125034
H   -4.5047430288  -0.5116505703  -1.4025891738
H   -4.9280282494   1.1714045711  -1.1172033979
H   -3.3520868590   0.7666794182  -1.7860526207
H    1.1837616651   0.2302380208   2.5171099400
H    2.0321533125   3.1816633478  -1.3322734053
H    2.6469692269   2.1634475303   2.7873505399
H   -0.0252573037  -3.9381295075   1.3041494148
H   -2.3557830757  -4.5978489795  -2.0448579579
*
