! 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  -0.2174135045  -0.9027136883   2.8701317118
Cl  -4.5858936485  -2.5716604587   0.2664625941
O    3.0046072434  -0.3484002385  -0.6228040096
N    1.7848136789  -0.9382768791  -0.5604362327
N    3.0587142866   3.7043978959  -1.2375434399
C    1.2243090127   1.0786400594   0.7417087069
C    0.9430461519  -0.2640867243   0.1135360785
C   -0.4168191911  -0.8449463128   0.1698103304
C    1.5095776543   2.1311748803  -0.2981546354
C   -1.0523469274  -1.1410387930   1.3735778271
C   -1.1071741415  -1.1214581393  -1.0078998762
C    0.5494569109   2.5261133374  -1.2216611078
C    2.7488532718   2.7585692907  -0.3620734298
C   -2.3315264872  -1.6691606991   1.4184362876
C   -2.3857066821  -1.6525474002  -0.9947492246
C   -2.9884685694  -1.9151995549   0.2240176634
C    0.8636327089   3.5077548059  -2.1478993100
C    2.1305336583   4.0683242119  -2.1140603485
C    3.8635768590  -1.0877665793  -1.4704349269
H    0.3655305248   1.3901065167   1.3361583386
H    2.0698242108   1.0025955172   1.4289474873
H   -0.6351884988  -0.9083628547  -1.9578240680
H   -0.4374279216   2.0775467626  -1.2205633474
H    3.5275777480   2.4793387164   0.3408639508
H   -2.7994622019  -1.8946575053   2.3665957855
H   -2.9008170836  -1.8532989773  -1.9237761322
H    0.1399918896   3.8365292422  -2.8813724236
H    2.4059295134   4.8428612964  -2.8210753476
H    4.8216642757  -0.5712818856  -1.4570779224
H    3.4917211767  -1.1150252437  -2.4973168885
H    4.0065816142  -2.1102549232  -1.1133511204
*