! 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  -0.2603191147   2.2397293123  -1.6453443338
Cl  -4.4609609343  -0.2557719698   0.5972679642
O    0.9943642193  -0.3194139765  -1.5328787223
O    4.4128900279   0.9458085072   2.2060492094
O    3.1944831920  -0.8114752965   2.8304290648
C    2.4143648813  -1.3775417884   0.1612576719
C    1.9217731143  -1.3695107167  -1.2735027122
C    3.1236687105  -0.0859068002   0.5358398090
C   -0.2389609359  -0.3797986902  -1.0141647611
C    3.5666457071  -0.0520635780   1.9700001479
C   -0.9836704247   0.8039209675  -1.0186571149
C   -0.8380213596  -1.5244941302  -0.4957239021
C   -2.2774674896   0.8503950717  -0.5337040544
C   -2.1332705058  -1.4912028214  -0.0023201661
C   -2.8452049213  -0.3059671329  -0.0227376602
H    3.1011505737  -2.2220297139   0.2574640059
H    1.5911165103  -1.5735214889   0.8509298529
H    1.5015899494  -2.3409498761  -1.5486884879
H    2.7481863225  -1.1797404832  -1.9591601102
H    2.4698797393   0.7796794533   0.3833138943
H    3.9900770485   0.0821153851  -0.1092219749
H   -0.3076594465  -2.4664119667  -0.4714539405
H   -2.8283930942   1.7807105040  -0.5496470972
H   -2.5737713632  -2.3953828081   0.3946785072
H    4.6507856657   0.9618054833   3.1455585545
*