! 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   2.8598956274  -1.8315711454   0.1850745095
Cl   3.5800325916   1.2352681136  -0.0226738055
O   -3.3017455030   1.2616029174  -0.1539512618
N   -2.0338099739  -0.6186480952   0.0067718239
C   -0.7360476519  -0.1158711688  -0.0056624688
C   -4.4294709039  -0.8521841195  -0.0198933255
C   -3.2186998063   0.0514519317  -0.0638602654
C    0.2983507244  -1.0489005068   0.0810735472
C   -0.4121391265   1.2397677458  -0.0976961343
C   -5.7410917538  -0.0964708822  -0.0967948570
C    1.6198310450  -0.6418162943   0.0761318508
C    0.9146947524   1.6321746370  -0.1010876828
C    1.9409328641   0.7067488566  -0.0151017786
H   -4.3554891489  -1.5724325514  -0.8404651647
H   -4.3857737366  -1.4478248733   0.8970770895
H   -2.1025796042  -1.6233891183   0.0780887604
H    0.0730367689  -2.1059741292   0.1534913115
H   -1.1757795343   1.9953611028  -0.1669727914
H   -5.8304498038   0.4708704334  -1.0233378422
H   -5.8598256687   0.5984533686   0.7346401098
H   -6.5757290273  -0.7967148984  -0.0599698980
H    1.1495078874   2.6856606498  -0.1729657063
*