! 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  -0.1257283387   0.1502263390  -2.6909564619
Cl   4.0953670413  -2.1758980869  -0.4216384614
O   -2.3055878206  -0.1019256573  -0.6723007536
O   -1.8302183031   0.1364019618   1.4929021721
N   -0.1269589838   2.4828518920   0.6777489805
N   -0.0890112492   2.5864202074   2.0073491337
N    1.8538730269   3.2499112992   1.1143499395
C   -1.3475758773   0.3945052473   0.2031115486
C   -2.8383961173  -1.2716463616  -0.0642910900
C   -2.7987506076  -0.9022326483   1.4183437057
C   -1.2547798239   1.9126536572  -0.0084240602
C    0.0133252884  -0.2789848842   0.0102914375
C   -4.2172964838  -1.5659908192  -0.6126239278
C   -4.8148293548  -2.8166053549   0.0156883790
C    0.6241717936  -0.4179629663  -1.2352553407
C    0.7208366820  -0.7370204861   1.1178891975
C    1.8744128116  -1.0003173200  -1.3781218660
C    1.9699092414  -1.3233724069   1.0053109109
C    1.0414062170   2.8729219540   0.1593757660
C    2.5361869592  -1.4511858193  -0.2497046938
C    1.1139248482   3.0528028693   2.2233078921
H   -2.1752409966  -2.1250226709  -0.2617196012
H   -3.7609982867  -0.5158293476   1.7688306955
H   -2.5087336537  -1.7401927748   2.0543786222
H   -2.1726299244   2.3849544424   0.3413141462
H   -1.1466300584   2.1375588390  -1.0675198066
H   -4.1507779852  -1.6975075466  -1.6947287943
H   -4.8690313291  -0.7073202555  -0.4317401043
H   -4.9656705957  -2.7038052571   1.0906206555
H   -5.7867328784  -3.0420105845  -0.4229366626
H   -4.1765824806  -3.6876867099  -0.1393858444
H    0.2876582274  -0.6317313450   2.1019954057
H    2.3232914063  -1.0956990205  -2.3571017964
H    2.4888598255  -1.6705187615   1.8878843793
H    1.2444797943   2.8742112457  -0.9005792522
H    1.4712187246   3.2642461963   3.2191225576
*