! 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  -1.0089895960   0.7887320984  -2.7131251861
Cl  -4.7805940103   3.0841257679   0.2945060693
F    3.9694835622   1.4745531126  -0.1192443749
F    3.7320651530   0.2729249710   1.6585685038
F    4.8454362932  -0.7405874382  -1.5080340529
F    4.6027563996  -1.9506404845   0.2953072785
O    2.5353019137  -0.2355082825  -0.1561698775
N   -1.0145162175  -2.3259019522   0.8495714592
N   -1.8266408453  -2.4203440073   1.9032556407
N   -2.6462281882  -3.5888957115   0.1806708692
C    0.1526933863  -0.3682162190  -0.1034910669
C    0.1915269822  -1.5278848084   0.8953132928
C    1.3563828456   0.5477854204   0.0788290658
C   -1.0959014779   0.4758584040  -0.0103964507
C   -1.6863122808   1.0460991875  -1.1376269262
C   -1.6836801296   0.7634885303   1.2192196849
C    3.7038554718   0.2127478020   0.3018002418
C   -2.8157395188   1.8461385209  -1.0601389914
C   -2.8101305076   1.5598874906   1.3313890587
C   -1.5146945690  -3.0251884417  -0.1707656117
C   -3.3704392203   2.0918790188   0.1830971745
C    4.8397537026  -0.6999093050  -0.1577827470
C   -2.7895683385  -3.1864780075   1.4573257955
H    0.2126176460  -0.7969109688  -1.1068643737
H    1.0453718606  -2.1678137927   0.6769664826
H    0.3027046704  -1.1842000853   1.9224134799
H    1.3138322786   1.3680047131  -0.6404637805
H    1.3566556410   0.9744598471   1.0853866037
H   -1.2598445481   0.3586493826   2.1281387998
H   -3.2507943470   2.2685872054  -1.9551212411
H   -3.2405628212   1.7568328782   2.3032109794
H   -1.0279010903  -3.1017459030  -1.1306931151
H    5.8112882321  -0.3580954678   0.2021932524
H   -3.6258509523  -3.4678447599   2.0783793797
*