! 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  -0.9510710985   1.8410985105   1.7815465116
Cl  -4.9742405779   2.3763457083  -1.6682357417
F    3.9973357930   0.8762294484  -1.1826807339
F    3.8885329182   1.0287734241   0.9656739476
F    6.0143679694  -0.4004518010   0.0815388675
F    4.6907031689  -1.7911871819  -0.9598154733
O    2.5260652461  -0.3958685802  -0.0869355812
N   -1.1443666541  -2.0659579616   1.1186850236
N   -1.3442313187  -3.0166202476   0.2058025222
N   -3.1169372163  -2.8495472501   1.5637911984
C    0.1560596625  -0.4399491248  -0.1751758772
C    0.0587613071  -1.2695769816   1.1123087628
C    1.3807331523   0.4653675442  -0.1909545765
C   -1.1141839412   0.3181230576  -0.4910350785
C   -1.6822118264   1.3213609351   0.2938917068
C   -1.8043809031  -0.0240676881  -1.6535351592
C    3.7406886095   0.1566420256  -0.0628197932
C   -2.8633071609   1.9581926090  -0.0571726670
C   -2.9837231308   0.5911149633  -2.0343447335
C   -2.2095936012  -1.9702036606   1.9169111131
C   -3.5039713607   1.5857102487  -1.2252316064
C    4.7813880931  -0.9520690513   0.0958132019
C   -2.5376913566  -3.4607067724   0.5127852241
H    0.2911897964  -1.1518555437  -0.9942724228
H    0.9155068642  -1.9368790443   1.1927822790
H    0.0464768309  -0.6491802828   2.0055407464
H    1.4081632844   1.0210281349  -1.1301978208
H    1.3737259282   1.1772008857   0.6339030960
H   -1.4007961614  -0.8044715331  -2.2859185348
H   -3.2756902062   2.7313419834   0.5767759670
H   -3.4852227232   0.2925067704  -2.9446657369
H   -2.2746258872  -1.2648445592   2.7312983053
H    4.6422783994  -1.5119179839   1.0219849944
H   -3.0069516228  -4.2590387348  -0.0418752579
*