! 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   3.4623426472   1.5888538625  -0.0026050167
O   -2.6522366150  -1.5713245935  -0.0009664035
N   -1.4133864460   0.3423385869   0.0065241967
N   -3.7072633543   0.4409077884   0.0011786696
C   -0.1188074842  -0.1708372377   0.0042599127
C    2.6068468773  -0.9769051753  -0.0002246209
C    0.9128098522   0.7719081107   0.0025341704
C    0.2238753769  -1.5230419459   0.0038138934
C    2.2322908349   0.3641989235   0.0002263486
C    1.5607431156  -1.8925365883   0.0016239798
C   -2.6026126616  -0.3434142845   0.0019367618
C    4.0371361453  -1.4163521887  -0.0026985698
C   -5.0262552608  -0.1562164954  -0.0057551598
C   -3.6492946247   1.8900784507   0.0009701951
H    0.6788029677   1.8293767148   0.0029790093
H   -0.5291118052  -2.2914939900   0.0051966497
H   -1.4526393057   1.3490891558   0.0070287467
H    1.7987189082  -2.9491691978   0.0010133107
H    4.5752709606  -1.0502359378   0.8730031610
H    4.1032798234  -2.5029460250  -0.0016485855
H    4.5716288364  -1.0522393476  -0.8814694515
H   -4.9597690625  -1.2384141878  -0.0103691114
H   -5.5848338116   0.1538604845  -0.8900865532
H   -5.5909193008   0.1458305033   0.8775212132
H   -3.1570726460   2.2871905844  -0.8893886429
H   -3.1529489095   2.2868399003   0.8890429887
H   -4.6630892989   2.2797745564   0.0038136158
*