! 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 "1-OCTANOL"
end
*xyz 0 1
Cl  -5.8924980113  -1.1129759388  -0.4873455076
O    0.0605550838   1.7983358709   0.2577025840
N    1.4574517931   1.6369740914   0.0435657310
N    5.0991158927   0.1104267528   1.1644072893
C    1.6069843704   0.2058442952  -0.2678225979
C    0.7241418926  -0.3809777112   0.8452035299
C   -0.3578866055   0.7005768433   1.0418711613
C    3.0602720916  -0.1821437566  -0.0780088936
C    1.0730726589  -0.1902462478  -1.6455875980
C   -1.7432687297   0.2778492258   0.6264223848
C    1.8271282735   2.5655614671  -0.9958798239
C    3.6760946429  -1.1707661912  -0.8347072424
C    3.8350326371   0.4205118653   0.9147946950
C   -2.3782211324  -0.7277991694   1.3513040234
C   -2.4189259525   0.8509995850  -0.4439029717
C    4.9963145275  -1.5087386891  -0.5768280629
C   -3.6479620554  -1.1650948301   1.0155476733
C   -3.6951658729   0.4266464378  -0.7909748169
C    5.6669979621  -0.8398378313   0.4305683473
C   -4.2992240586  -0.5799748686  -0.0600685682
H    0.3166200398  -1.3544090224   0.5743796641
H    1.2955659295  -0.5077114097   1.7644382805
H   -0.3883007865   0.9888100382   2.1003695356
H    0.0655988562   0.1938806320  -1.8037926822
H    1.0100243575  -1.2737448917  -1.7420110661
H    1.7014831390   0.1789109850  -2.4571523631
H    2.8789770889   2.4119931098  -1.2351629696
H    1.7235262261   3.5858403727  -0.6265520672
H    1.2422673244   2.4697510991  -1.9168820229
H    3.1444494060  -1.6870464114  -1.6222838439
H    3.4049965997   1.2008571458   1.5311334413
H   -1.8780880354  -1.1844751909   2.1973252917
H   -1.9625173986   1.6392084043  -1.0257092816
H    5.4955643197  -2.2769887599  -1.1513043222
H   -4.1218822264  -1.9496106671   1.5891442990
H   -4.2072214552   0.8854125369  -1.6259039492
H    6.7003390674  -1.0781589892   0.6560629088
*