! 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   5.4380372412   1.7470979087  -0.3545227031
O   -2.1534104017  -0.5652909904   1.5954601642
N   -1.1871071461  -2.4483103148  -0.4314375060
N   -0.6084013274  -2.7037801722   0.7463046504
N    0.5967635036  -3.5901101633  -0.9100257710
C   -2.3468837807  -0.3263859277   0.2191656849
C   -3.7315724553   0.3924130978   0.0886634868
C   -1.1645329206   0.4848834963  -0.3761525921
C   -2.4139252768  -1.6805715490  -0.5296816725
C   -3.6488602952   1.8301341557   0.6096675087
C   -4.2053448209   0.4473832581  -1.3676717288
C   -4.8056739608  -0.3315576367   0.9118349450
C   -0.5200909715   1.5545863373   0.5250767382
C    0.9665743382   1.6303230087   0.3143682617
C   -0.4553684958  -2.9814046440  -1.4088925509
C    1.8039189746   0.6677946497   0.8773503791
C    1.5472598884   2.6271868835  -0.4622224579
C    0.4593269397  -3.3868710756   0.4102951794
C    3.1744743848   0.6941355983   0.6793409322
C    2.9191425963   2.6718186050  -0.6747850781
C    3.7224182221   1.7019939672  -0.1000753667
H   -1.4629524246   0.9348676571  -1.3255943266
H   -0.3753215894  -0.2203818651  -0.6460574148
H   -3.2283861798  -2.2952022833  -0.1454459142
H   -2.5845562766  -1.5294118171  -1.5934625012
H   -3.0600267831   2.4751844872  -0.0428471335
H   -3.2315514319   1.8874083877   1.6151430478
H   -4.6514768239   2.2612035373   0.6523962009
H   -3.4537479091   0.8606829287  -2.0425133771
H   -5.0847312384   1.0897202702  -1.4436304817
H   -4.5010247647  -0.5293655468  -1.7536824567
H   -4.9077379625  -1.3876283189   0.6566256490
H   -4.6202316080  -0.2665805721   1.9831158644
H   -5.7776297431   0.1289978915   0.7229820442
H   -0.7140971437   1.3247681080   1.5733289984
H   -0.9580398040   2.5343337681   0.3380445378
H   -1.4502752522  -1.2250941914   1.7025494921
H   -0.7231746509  -2.9023353611  -2.4509126943
H    1.3804240559  -0.1215004399   1.4880375102
H    0.9248707971   3.3910635077  -0.9129121740
H    1.1580826097  -3.7494029553   1.1480416416
H    3.8046719109  -0.0609011311   1.1301655472
H    3.3501370265   3.4570590485  -1.2813264314
*