! 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  -4.4730038189   2.0040365765  -0.4610973236
F   -0.9770409100  -2.7549808746   0.3101761272
F    0.0387430383  -1.5097459035   1.7371669652
F   -2.0663748545  -1.8632135817   1.9314024333
O    1.3837648039   2.0238441319   0.0018568989
N    2.9662477758  -1.1253323462  -1.0265291411
N    0.7542792544  -0.6873232346  -0.8649104476
N    3.9595005281  -3.0407297797  -1.4806602441
C    1.9214105878  -0.2230762854  -0.7764249457
C    2.3900331001   1.1786733040  -0.4353570726
C    1.0823863706   1.9243852746   1.3830177025
C   -0.4410438717  -0.0031579643  -0.7501926163
C   -0.1135236143   2.8000314236   1.6868495730
C   -1.3936657190  -0.4459163500   0.1768383735
C   -0.7906330444   1.0274247387  -1.6229265562
C   -2.6307016200   0.1802268705   0.2711419331
C    4.3200551967  -0.8613616944  -1.0996735880
C   -0.5337076902   2.6833848380   3.1429467687
C    2.8185409388  -2.4631938146  -1.2699742496
C   -1.0971841678  -1.6375243364   1.0378045845
C   -2.0266113130   1.6369197842  -1.5476568676
C   -2.9345207522   1.2214281733  -0.5853431992
C    4.9053368537  -2.0504667940  -1.3845154981
H    2.8284209509   1.6122733393  -1.3404894219
H    3.1998923928   1.1019159769   0.3017331586
H    1.9509337079   2.2404675541   1.9768263996
H    0.8690589903   0.8874744249   1.6667714343
H    0.1246105187   3.8398112926   1.4478056013
H   -0.9459978908   2.5084257999   1.0424613272
H   -0.0863392940   1.3499102176  -2.3775188962
H   -3.3621565557  -0.1414598333   0.9985428416
H    4.7448788505   0.1170550694  -0.9614606449
H   -0.8306252646   1.6626839035   3.3908505471
H    0.2723333724   2.9675690270   3.8214492709
H   -1.3840847095   3.3311338847   3.3555155441
H    1.8513863550  -2.9377358413  -1.2640869334
H   -2.2725777853   2.4388177140  -2.2302317439
H    5.9561215599  -2.2493839614  -1.5231328675
*