! 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  -0.3623010550   1.7983201240  -2.5729250218
Cl  -3.8484453276   0.3530477691   1.2548597210
O    1.1676296660  -0.4247238359  -1.6713355339
O    1.7574977147  -0.0966652066   2.9313781708
O    2.6578503707  -1.8705185410   1.9288878145
C    3.2718896349  -0.3732603839  -0.4365456495
C    2.2741126810  -1.2049564102  -1.2224231023
C    2.7600319524   0.2750072946   0.8408854295
C    0.0490027544  -0.3116157890  -0.9462301721
C    2.3941562139  -0.6922827409   1.9295403126
C   -0.8136636269   0.7363906596  -1.2898105711
C   -0.3387972624  -1.1541024221   0.0923651791
C   -2.0087665845   0.9440588050  -0.6272039723
C   -1.5308442937  -0.9516079152   0.7708539014
C   -2.3589705284   0.0946218506   0.4101886291
H    3.6519653410   0.4179453434  -1.0860486394
H    4.1247440309  -1.0183258917  -0.2138863621
H    1.9515288652  -2.0890393206  -0.6726467109
H    2.7546539971  -1.5650715598  -2.1320690230
H    1.9167828737   0.9429972565   0.6496201185
H    3.5422993206   0.9256145722   1.2461155325
H    0.2713149263  -1.9943590507   0.3908099518
H   -2.6517549140   1.7639950301  -0.9162419932
H   -1.8011266023  -1.6214843455   1.5751953793
H    1.5553943953  -0.7430133481   3.6250389908
*