! 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   0.4311253569  -1.9316276998  -1.9222984836
Cl   5.2210755934  -0.7731976171   0.1656258175
O   -1.0660551204   1.4872625751   0.4163018809
N   -2.8653663858  -0.7687520921   0.6339814429
N   -4.9532441502  -0.0679696067   0.7380629902
C   -0.7220329965   0.2175500471  -0.0589274853
C   -1.4354300265  -0.7974640950   0.8295285736
C    0.7705299460  -0.0276018757  -0.0191336732
C    1.3820839492  -0.9842709230  -0.8228862650
C    1.5823879752   0.6827856406   0.8588754227
C   -3.5591526085  -1.4768282527  -0.3096369542
C   -3.7443231148   0.0713056606   1.2194002111
C   -0.8592025390   2.5323565524  -0.5015308855
C    2.7456583166  -1.2261241548  -0.7803682584
C    2.9481521781   0.4649872882   0.9279850547
C    3.5173257524  -0.4890690322   0.1013613214
C   -4.8457891001  -1.0367201403  -0.2227785906
C   -1.1834623871   3.8456051271   0.1201171553
C   -1.5986675682   4.0439422178   1.3645373815
H   -1.0785496180   0.0898395703  -1.0909476156
H   -1.0808901722  -1.8058131127   0.6223712039
H   -1.2132262310  -0.5919741276   1.8775078724
H    1.1419760660   1.4315053779   1.5036349749
H   -3.0882422163  -2.2197739940  -0.9322909564
H   -3.4531281403   0.7533625537   2.0024818184
H    0.1804705740   2.5587127094  -0.8574621622
H   -1.4805335585   2.3890803078  -1.3970808201
H    3.1927278937  -1.9721155593  -1.4224144100
H    3.5547984580   1.0343462323   1.6178398029
H   -5.6965149215  -1.3706143517  -0.7953564350
H   -1.0508055878   4.6922500512  -0.5454798062
H   -1.8096795851   5.0426245729   1.7234252324
H   -1.7518162142   3.2359745924   2.0677494727
*