! 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   0.9130714681  -0.0926683512   2.1544554727
Cl   4.2131775522  -1.9963175506  -1.5482441676
O   -2.2186212413  -0.4791068257  -1.0669936042
O   -1.7701757472  -0.1725181371   1.0949391357
N   -0.4024402842   2.3628681232   0.3487341812
N   -0.7063763533   2.8051144802   1.5714002782
N    1.4219890190   3.3043222757   1.0614412716
C   -1.2976661650   0.1022602683  -0.1813632737
C   -2.9808849076  -1.4698861162  -0.3683829715
C   -2.3351991739  -1.4695732114   1.0154872282
C   -1.3356275979   1.6113892083  -0.4472143780
C    0.1003982007  -0.4677830424  -0.4432812718
C   -4.4499582161  -1.0907375075  -0.3574714636
C   -5.0430554986  -0.9272229288  -1.7476487839
C    1.1189372880  -0.5652343460   0.5038684135
C    0.4118116314  -0.8498119695  -1.7476338267
C    2.3813292105  -1.0406861728   0.1706663634
C    1.6622236631  -1.3174233614  -2.1081808905
C    0.8673796114   2.6597456569   0.0657926175
C    2.6409867615  -1.4124179691  -1.1343570891
C    0.4141704603   3.3577157917   1.9526140280
H   -2.8463917887  -2.4335370522  -0.8679534300
H   -3.0488679728  -1.5904613761   1.8294498617
H   -1.5669296563  -2.2448511935   1.1082860608
H   -2.3389979759   1.9865391526  -0.2499310763
H   -1.1095174416   1.7917841861  -1.4973906496
H   -4.5849246122  -0.1724747558   0.2223334967
H   -4.9863067322  -1.8776598808   0.1791080613
H   -4.5713793915  -0.1120253566  -2.2961564082
H   -4.9282432016  -1.8379226194  -2.3384923852
H   -6.1090729366  -0.7069422619  -1.6897463786
H   -0.3451214651  -0.7819026606  -2.5159967193
H    3.1496901781  -1.1123157107   0.9276336062
H    1.8626058106  -1.6019769005  -3.1313860290
H    1.3317416973   2.4128083229  -0.8762394408
H    0.5081026720   3.8310976355   2.9171959423
*