! 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   5.0893726630   2.5171418520  -1.6070736470
O   -2.5454058124  -0.1592975970   1.7785044974
N   -1.3246032813  -2.5126434066   0.5721284045
N   -0.2914126088  -2.8058439653  -0.2219821070
N    0.1163918482  -3.4921391928   1.8739240849
C   -2.4046606376  -0.2639374531   0.3733947618
C   -3.6075266996   0.4451578916  -0.3430731475
C   -1.0540987294   0.3265215854  -0.1042458122
C   -2.4720205718  -1.7730075357   0.0964531525
C   -3.4093185094   0.4809693766  -1.8615952343
C   -4.9306758917  -0.2691836246  -0.0427292921
C   -3.7411788407   1.8882321152   0.1601106281
C    0.0726939989   0.3628570399   0.9358219591
C    1.3363679807   0.8955254206   0.3210952494
C   -1.0642184946  -2.9204536066   1.8137493515
C    1.5681429948   2.2667674661   0.2466278767
C    2.2907129107   0.0382602282  -0.2198369627
C    0.5429530266  -3.3882813047   0.6016784022
C    2.7150720768   2.7748315322  -0.3446950315
C    3.4458885586   0.5251489508  -0.8136240437
C    3.6471405801   1.8946968241  -0.8709418804
H   -1.1986167586   1.3529494962  -0.4476544166
H   -0.7134062982  -0.2228941445  -0.9846272494
H   -3.3506277072  -2.2020335923   0.5758848660
H   -2.5529125935  -1.9710537586  -0.9694031108
H   -2.5528658884   1.0863529210  -2.1596026755
H   -4.2895965808   0.9187580568  -2.3360895329
H   -3.2788773390  -0.5120696043  -2.2945704315
H   -5.7658481839   0.3374851072  -0.3974354290
H   -5.0777920364  -0.4282504094   1.0262960272
H   -5.0119416823  -1.2349737354  -0.5434854491
H   -4.5170485246   2.4015392552  -0.4101344754
H   -4.0420308978   1.9396630046   1.2081869765
H   -2.8276745528   2.4734658712   0.0416171781
H    0.2668408586  -0.6199932179   1.3640586221
H   -0.2102248614   1.0093585749   1.7690035459
H   -2.4290659327   0.7598463845   2.0413782365
H   -1.7571044739  -2.8017260105   2.6307390981
H    0.8445740337   2.9582718613   0.6616612520
H    2.1372394493  -1.0330904969  -0.1757419148
H    1.4946978406  -3.7685526831   0.2649412412
H    2.8783497109   3.8429787625  -0.3886202252
H    4.1781770764  -0.1582069708  -1.2215507269
*