! 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   2.9459990563   2.2437328749   1.4412408103
O   -3.3388249938   1.4824918210  -0.4210381096
O    0.5051514779   0.4059172543   1.3374094956
N    0.2739457717  -1.1454310938  -0.2882486340
N    4.4771392099   0.6222655126   0.0312342188
N    4.5054481557  -0.5091702426  -0.6781294729
C   -4.2734515737   0.4401071000  -0.1435319818
C   -3.4097063795  -0.7834088236  -0.0057587824
C   -1.9868265240   1.0359545388  -0.4428944943
C   -2.0790105251  -0.4354871938  -0.1564261469
C   -5.2483321573   0.3203901262  -1.3088929665
C   -5.0112942770   0.7574079855   1.1519342117
C   -1.0949933565  -1.4166506101  -0.0884637502
C   -3.8029922779  -2.0933522138   0.2048336259
C   -1.3535703216   1.3669201480  -1.7832043532
C   -1.4832237191  -2.7375104020   0.1244911382
C   -2.8220465351  -3.0741554679   0.2640925928
C    1.0004381038  -0.2693316528   0.4502265996
C    2.4240949030  -0.1650131917   0.1046125965
C    3.2854044386  -1.0006305257  -0.6524226925
C    3.2580225316   0.8591621796   0.5191917814
C    2.9966246018  -2.2856725986  -1.3459097364
C    5.6645367072   1.4316766260   0.1788604680
H   -1.4337128151   1.5506460105   0.3501380054
H   -4.7267792571   0.0992896038  -2.2413439729
H   -5.8080928071   1.2482463188  -1.4430209946
H   -5.9725804220  -0.4766111573  -1.1334522135
H   -5.7246590256  -0.0308618689   1.3971519171
H   -5.5706743395   1.6907026545   1.0615722171
H   -4.3190229224   0.8540234388   1.9896802890
H   -4.8476247925  -2.3580070280   0.3136733012
H   -1.4042559487   2.4399242639  -1.9744692680
H   -0.3007961684   1.0847856586  -1.8020784516
H   -1.8569202815   0.8476234729  -2.6005109672
H   -0.7252727422  -3.5091255563   0.1827566037
H   -3.0964969559  -4.1081681285   0.4263500937
H    0.7458167557  -1.7348939505  -0.9552977591
H    3.9179603109  -2.7049562895  -1.7465607383
H    2.5668986158  -3.0267169961  -0.6699443742
H    2.3141762485  -2.1563359600  -2.1890921676
H    5.5293941651   2.4089004594  -0.2812950857
H    5.9202555486   1.5594892381   1.2288907807
H    6.4780252834   0.9160472366  -0.3210515441
*