! 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   0.1031693844   2.6484513426   0.1669605928
Cl  -3.8180818359  -1.0639954520  -0.4528939837
F   -1.5127127700  -2.8296023562  -0.2059750680
O    1.7348117625   0.2721892008   0.2942074292
O    4.1458296122   0.9732314895  -0.1696821304
O    5.0134031567  -0.9315888201   0.6145892393
N    0.0859507758  -1.2961627483   0.0498538792
N   -2.7264472878   1.7293291085  -0.2063473452
C   -1.8153338027   0.7566600359  -0.1325095537
C    0.4534300207  -0.0308157479   0.1298790817
C   -0.4491041170   1.0205489537   0.0485134958
C   -2.1752100870  -0.6050819016  -0.2235447714
C   -1.1833669345  -1.5473397158  -0.1232215669
C    2.6620095405  -0.7888451136   0.3906693084
C    4.0663848524  -0.2525008557   0.3065138402
H    2.5495344588  -1.3353806396   1.3300671044
H    2.5396875463  -1.5106919615  -0.4235113496
H   -3.6929743553   1.5255444090  -0.3912867233
H   -2.4574792609   2.6975770589  -0.1926782048
H    5.0758383946   1.2427164580  -0.2312327196
*