! 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  -5.4050908526   1.6759147996  -1.9632121448
O    1.1718582272   1.3050363809  -0.4462772678
O    2.2457835600  -1.5388904842   2.3538851876
N    1.7062411581  -0.7574683032   0.2938283264
N    2.4526492141  -2.9646747896   0.5977914204
N    2.3706234822  -5.1459179568   0.3274748951
C    1.4300734647   0.6364707235   0.7635330224
C    1.3991013611  -0.8907014792  -1.1536280322
C    0.5768751920   0.3875798341  -1.3251058937
C    0.2021729696   0.6563016286   1.6844087439
C    2.6547450667   1.2875691437   1.3824740988
C    2.6552416511  -0.8149767810  -2.0166911564
C    0.5487709869  -2.0959236237  -1.5270718738
C   -0.1421656212   2.0042171405   2.3154443226
C    2.1255311592  -1.6852420403   1.1554672484
C   -0.5965694536   3.1230426484   1.3747460388
C   -1.7933731270   2.7667193847   0.5360828956
C    3.6351282412  -3.3243621446   0.0000538535
C    1.7420801511  -4.1052139057   0.7934585666
C   -1.7483638382   2.8230248565  -0.8533021124
C   -2.9900011726   2.3717082553   1.1332301079
C    3.5546762355  -4.6734109671  -0.1666086200
C   -2.8505834400   2.4927551781  -1.6301065936
C   -4.1017942517   2.0358971716   0.3770631993
C   -4.0208079618   2.0972726996  -1.0056793223
H    0.6303115731   0.7800997863  -2.3406076152
H   -0.4798064787   0.2127659221  -1.0857683823
H    0.3741458164  -0.0441517170   2.5008334171
H   -0.6646791966   0.2708050184   1.1396255744
H    3.5406496313   1.1053502110   0.7731728569
H    2.8462545164   0.9270650896   2.3898756355
H    2.5097452837   2.3669639076   1.4391618294
H    2.3704485602  -0.7460149625  -3.0678621737
H    3.2778042980  -1.7013206427  -1.9156676470
H    3.2614989883   0.0591906989  -1.7767905588
H    1.1243516763  -3.0139985979  -1.6272162592
H   -0.2615815221  -2.2599795648  -0.8165097222
H    0.0933456485  -1.9057809106  -2.5011947122
H   -0.9360188459   1.8163843851   3.0434835660
H    0.7012596983   2.3685440524   2.9069452256
H    0.2209341745   3.4382000672   0.7262263916
H   -0.8419678059   3.9929228239   1.9915861199
H    4.4156010164  -2.6154797056  -0.2179479626
H    0.7697845084  -4.1007779458   1.2618752023
H   -0.8372679789   3.1334639322  -1.3492095007
H   -3.0682031095   2.3256449385   2.2130936787
H    4.2930727187  -5.3251523891  -0.6070549883
H   -2.7896187093   2.5440067828  -2.7090556318
H   -5.0192127049   1.7329217020   0.8638719396
*