! 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   5.3694197499   2.4485643602   0.3339123084
O   -2.5591245584  -1.0503383416   1.6042797402
N   -1.2525249501  -2.5996419491  -0.3776198282
N    0.0025952694  -2.5519477693  -0.8326454121
N   -0.2707450942  -4.3219774767   0.5083335874
C   -2.2983257186  -0.4574236080   0.3431193381
C   -3.5270883472   0.4641481709   0.0401839154
C   -0.9467499724   0.2724159521   0.4622439925
C   -2.2247447627  -1.5836185823  -0.7111611028
C   -3.4409709485   1.7566491283   0.8558704622
C   -3.6313615909   0.8263098119  -1.4467452661
C   -4.8366256317  -0.2396599237   0.4269484550
C   -0.3673321480   0.9826679508  -0.7634146489
C    1.0652563933   1.3670942809  -0.5174072279
C   -1.3997434017  -3.6575171324   0.4231880998
C    1.4008456607   2.6241812070  -0.0248577555
C    2.0899884187   0.4490774655  -0.7365805378
C    0.5528342088  -3.6017864458  -0.2762485632
C    2.7194762236   2.9660542874   0.2409385341
C    3.4130871174   0.7718784371  -0.4793207677
C    3.7166818582   2.0331420992   0.0096212288
H   -0.2076959871  -0.4699111248   0.7853639246
H   -1.0136941759   0.9872290667   1.2862746483
H   -3.1916954254  -2.0777246341  -0.8015155532
H   -1.9643989405  -1.2067936872  -1.6971138712
H   -2.6308960011   2.4106114944   0.5279281017
H   -3.3069380531   1.5607448856   1.9209093986
H   -4.3672943321   2.3244909670   0.7458196307
H   -2.7298330106   1.2862414826  -1.8485123320
H   -4.4409090618   1.5453546321  -1.5879175463
H   -3.8695521986  -0.0352290965  -2.0728567277
H   -4.9218980719  -0.4043965118   1.5000564786
H   -5.6815665316   0.3836409404   0.1261750305
H   -4.9688070619  -1.2031597591  -0.0696854699
H   -0.9419214079   1.8798422683  -0.9976235494
H   -0.4184030159   0.3385684670  -1.6433272189
H   -1.7263817573  -1.2906885867   2.0239270928
H   -2.3338770249  -3.9102214019   0.8996802578
H    0.6246037125   3.3586653134   0.1554442554
H    1.8490339195  -0.5387663038  -1.1114436936
H    1.5866059364  -3.8594054725  -0.4481277338
H    2.9608863011   3.9495612454   0.6212432936
H    4.1954390723   0.0469081726  -0.6600483528
*