! 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   0.3708127360   2.7392319149  -0.5135559332
Cl   4.1121379639  -1.0646080867   0.1352940481
O   -1.4626530459   0.7195380181   0.3051300880
O   -3.5647862374  -2.0929409939  -0.1805601697
O   -2.3569877216  -0.9234999414  -1.6573517431
C   -2.5370028950  -0.1372687040   0.6140474403
C   -0.2138582940   0.2290344389   0.2714409067
C   -3.7600471379   0.7350760510   0.8440614222
C    0.7966086979   1.1205590893  -0.0996128197
C    0.1482015271  -1.0739409625   0.5952914242
C   -2.7844844497  -1.0889552345  -0.5465583492
C    2.1225900230   0.7333216508  -0.1436410450
C    1.4750499513  -1.4757171764   0.5526624020
C    2.4538330855  -0.5716565492   0.1860832765
H   -2.3362611455  -0.7098867448   1.5266735813
H   -3.5682508130   1.4297706535   1.6607311984
H   -4.6158933679   0.1228084253   1.1221778481
H   -4.0175603287   1.3063353340  -0.0476089631
H   -0.5881554825  -1.8073427252   0.8938692318
H    2.8841583645   1.4438164790  -0.4346496300
H    1.7288650565  -2.4945417396   0.8097918891
H   -3.7643821777  -2.6607050736  -0.9415138958
*