! 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   4.3462550620  -1.6610994020  -0.3087717004
O   -1.7003958109   0.7449318802  -1.7624893560
N   -0.7748287975   2.2522792419   0.6041936591
N   -0.5067797702   2.9547709355  -0.5017569249
N    0.8441328756   3.5901985956   1.1659688335
C   -2.3246460454  -1.7966820239   0.9101476437
C   -3.1038237852  -1.3640142882   2.1161108744
C   -3.5086983973  -2.5931796966   1.3637240420
C   -2.4074719430  -1.0504675639  -0.4018390701
C   -1.4220920674   0.1431047033  -0.5157730219
C   -2.2452750091  -2.0367368350  -1.5551712850
C   -1.7253555894   1.1623632072   0.5995475407
C    0.0316589549  -0.3101693667  -0.4497811599
C    0.6675828284  -0.5642495029   0.7648730624
C    0.7663168628  -0.4909711662  -1.6186061800
C    1.9887486986  -0.9807445892   0.8182973164
C    2.0881672609  -0.9095416493  -1.5851302668
C    0.0457960570   2.6330062262   1.5794522502
C    2.6916580332  -1.1490586906  -0.3627093447
C    0.4663505403   3.7408886073  -0.1140688546
H   -1.3634166306  -2.2590708525   1.1113787397
H   -3.7405527173  -0.4919730491   2.0264329148
H   -2.6465378579  -1.4791485653   3.0906285920
H   -3.3326851108  -3.5586959223   1.8199568311
H   -4.4112353546  -2.5427520382   0.7659596803
H   -3.4113813713  -0.6119069593  -0.4709073552
H   -1.2863729863  -2.5557656043  -1.5099484105
H   -2.3262540386  -1.5611815999  -2.5310700234
H   -3.0274183755  -2.7945305122  -1.4965677686
H   -1.6935845089   0.7149723298   1.5888702073
H   -2.7313249916   1.5592713795   0.4554885720
H   -1.2257871206   1.5908130455  -1.7973301932
H    0.1437837188  -0.4461609798   1.7045279893
H    0.3125858609  -0.3050450149  -2.5816126325
H    2.4588959523  -1.1657781664   1.7742695789
H    2.6371969902  -1.0407721868  -2.5075503627
H    0.0170841731   2.2055637064   2.5690807862
H    0.9180487105   4.4534535489  -0.7857177840
*