! 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  -6.7381893295   0.5903693636   0.2766561605
F    4.0306080866  -2.3141844866  -0.1569206782
F    3.7959891937  -0.9263519074   1.4875739692
F    2.7361262484  -2.7695865153   1.4745501455
O    4.4324836377   0.2287874169  -0.8897175338
O   -1.5333950216  -2.0319587912  -0.3156404190
N    1.8630559683   2.3887438173   0.6152988092
N    1.2514214012   3.3424422935  -0.0909196329
N   -0.1586983295   2.4559203826   1.4044825241
C    3.2468088641   0.9791621078  -0.9388398979
C    2.0612117313   0.0213960552  -0.8548739496
C    3.1911495537   1.9263255167   0.2996726759
C    3.2544910203   1.8191694594  -2.2177515731
C    1.9796078831  -1.1330483987  -0.0491496392
C    0.8977590649   0.4055258572  -1.5187834358
C    0.7595780227  -1.7866029572   0.1048954501
C   -0.3113814550  -0.2474263831  -1.3796185559
C   -0.3831753882  -1.3332853426  -0.5295291172
C    3.1444728367  -1.7684517416   0.6782570618
C    1.0076959154   1.8632887976   1.4962882891
C    0.0447730765   3.3511494573   0.4178715452
C   -2.7181126064  -1.3633613474  -0.1806612784
C   -2.8183874080  -0.1373320573   0.4663625337
C   -3.8515671951  -1.9916502385  -0.6755044178
C   -4.0597342618   0.4637015412   0.6030675860
C   -5.0935182022  -1.3956196779  -0.5273689653
C   -5.1891250219  -0.1666169656   0.1051941674
H    3.5672167651   1.4082268793   1.1780324466
H    3.8302033237   2.7947996156   0.1326481740
H    3.1940689083   1.1913838785  -3.1074554025
H    2.4600509796   2.5615534662  -2.2581217634
H    4.1934634754   2.3761498971  -2.2627623197
H    0.9111106896   1.2633173580  -2.1726083442
H    0.6693644472  -2.6633985799   0.7295004421
H    5.1841553252   0.8311221659  -0.9284748195
H   -1.1768133550   0.1084670084  -1.9231635897
H    1.2770105564   1.0717595143   2.1782557625
H   -0.7155148220   4.0331299111   0.0697239094
H   -1.9471526913   0.3663003296   0.8676985832
H   -3.7672700876  -2.9487631591  -1.1737682812
H   -4.1369744028   1.4193083538   1.1036807045
H   -5.9747185694  -1.8891833283  -0.9137877796
*