! 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  -0.3702086911  -0.6490279629   2.7018186158
Cl   2.0501143428  -4.1900681236  -0.4529803001
O   -1.7252659108   1.2449596396   0.8924578164
O   -0.7796761791   1.7620539324  -1.0829582980
N    1.7486342497   2.2200729682   0.3326960245
N    2.0136800171   3.0041062048  -0.7162131131
N    3.7699856522   1.6817728063  -0.2610399776
C   -0.5153021623   1.2463597629   0.1918403810
C   -2.7942184302   1.3676500887  -0.0431851123
C   -2.1328591980   2.1899028279  -1.1360931264
C   -3.3210327821   0.0150108831  -0.4982828850
C    0.4496176651   2.1763492143   0.9502426546
C    0.0840677721  -0.1497447769   0.0471766437
C   -4.6233667884   0.1373412606  -1.2807305455
C    0.1985489991  -1.0403906582   1.1129574775
C    0.6149738263  -0.5515877978  -1.1756023154
C   -5.1562324375  -1.2141915522  -1.7298108287
C    0.7952536460  -2.2843480889   0.9679629420
C    1.2194445628  -1.7845827927  -1.3479015344
C    2.7975116935   1.4325927840   0.5793326179
C    1.3009058070  -2.6448224384  -0.2678381772
C    3.2316744449   2.6481733855  -1.0286356869
H   -3.5907748896   1.9268321188   0.4527214883
H   -2.5219671745   1.9924359691  -2.1351087246
H   -2.2105146719   3.2633057288  -0.9391890727
H   -3.4880835566  -0.6068136485   0.3856588999
H   -2.5721221510  -0.5014315337  -1.1081870404
H    0.5744957508   1.8408834156   1.9785992221
H    0.0389244138   3.1848432814   0.9805419105
H   -4.4775764169   0.7750938455  -2.1573634935
H   -5.3721953679   0.6393568483  -0.6611850963
H    0.5580240553   0.1119380403  -2.0257521817
H   -6.0981186328  -1.1103294363  -2.2693635774
H   -4.4506454493  -1.7182418489  -2.3925183865
H   -5.3355611360  -1.8726197487  -0.8779833042
H    0.8643219909  -2.9570616568   1.8113245115
H    1.6197610242  -2.0625199747  -2.3125197735
H    2.8182957570   0.7160996956   1.3857425832
H    3.7616946738   3.1152548452  -1.8437099963
*
