! 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   0.3750245823  -1.3914109904   2.2951275612
Cl   1.7168562285  -5.3597620898  -0.9975604553
O   -0.8667227116   0.6121061651   0.5516471989
O   -0.0304748452   1.0435793071  -1.4893249951
N    1.1949413455   2.6024060845   0.5113895012
N    0.6668635060   3.0598436865   1.6488827393
N    0.8431691220   4.7118449200   0.1473536476
C    0.2647520298   0.4603197271  -0.2516308617
C   -1.8297521252   1.4152116314  -0.1234045103
C   -1.4341637314   1.2173046136  -1.5748526217
C   -3.2285559773   0.9568775941   0.2309273591
C    1.4814780785   1.2069913845   0.3183155617
C    0.6051661818  -1.0183436193  -0.4057396194
C   -4.3200222311   1.7980175022  -0.4291733724
C    0.6772894895  -1.9029720768   0.6696191809
C    0.9070839678  -1.5227419795  -1.6668634080
C   -4.3400272804   3.2558789966   0.0123468625
C    1.0143127484  -3.2371836149   0.4960901429
C    1.2480220043  -2.8495985360  -1.8681815334
C    1.2866734086   3.5960479117  -0.3775716770
C    1.2945586844  -3.6990854500  -0.7777290119
C    0.4747272206   4.3270428049   1.3862734139
H   -1.6932704784   2.4638053563   0.1696429261
H   -1.9176064328   0.3332930815  -2.0096268366
H   -1.6375486142   2.0770096020  -2.2121242056
H   -3.3517798423   0.9963551233   1.3170519556
H   -3.3428643020  -0.0906256766  -0.0631429429
H    2.3183076511   1.1117651261  -0.3738173627
H    1.7913977980   0.7859001082   1.2721284223
H   -5.2844504330   1.3432048861  -0.1919958761
H   -4.2299397413   1.7448927045  -1.5187672742
H    0.8770663707  -0.8645414592  -2.5235996893
H   -5.2026856861   3.7768555813  -0.4050935180
H   -4.4015404192   3.3399802053   1.0994221206
H   -3.4531048527   3.8045229825  -0.3088544599
H    1.0580117503  -3.9029201991   1.3469629513
H    1.4739355899  -3.2075563245  -2.8629452669
H    1.6874006405   3.4627038858  -1.3698790320
H    0.0601483280   5.0029953736   2.1181762273
*