! 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   0.1674428757  -1.4929040625   2.4238449101
F   -4.5019282727   2.6610408310   0.1744554034
O    0.9509338034  -0.0742645974  -1.6015321614
N    3.0997498102   1.1521964710  -0.3040380169
N    3.7932247718   0.3615264531   0.5192753857
N    4.9405563805   0.7295371657  -1.3683942705
C    0.6828351748   0.6480993070  -0.4220623937
C    0.8868827826  -0.8067694520  -0.3897487739
C    1.7745649470   1.6128889939   0.0110666111
C   -0.6980902299   1.1953562085  -0.2775414435
C   -0.2732494348  -1.7192323867  -0.2272132368
C   -1.1536283402   1.6031388593   0.9731910381
C   -1.5483920261   1.2953426712  -1.3725441971
C   -0.6913245165  -2.0981231973   1.0430089870
C   -0.9758191111  -2.2077973058  -1.3220228951
C   -2.4367160079   2.1018374265   1.1350133319
C   -2.8355234920   1.7909863199  -1.2275931687
C    3.7916172110   1.3565650041  -1.4267756914
C   -1.7805748302  -2.9309196514   1.2359051824
C   -2.0655409043  -3.0472441696  -1.1480754196
C   -3.2563367676   2.1842020794   0.0266794158
C   -2.4694138587  -3.4057978952   0.1295622083
C    4.8890928942   0.1368657997  -0.1593061644
H    1.8412063384  -1.1919248008  -0.0337191662
H    1.7196480752   1.7971553742   1.0832130139
H    1.6226009705   2.5689027598  -0.4910713026
H   -0.5162767190   1.5238391099   1.8445783388
H   -1.2164607093   0.9838269922  -2.3534661470
H   -0.6681340151  -1.9272407861  -2.3206453918
H   -2.7920962765   2.4132594198   2.1084230897
H   -3.4984652249   1.8673658371  -2.0795154065
H    3.4266731301   1.9662615882  -2.2385276446
H   -2.0913676451  -3.2034518348   2.2354384088
H   -2.6005595605  -3.4188327008  -2.0118585153
H   -3.3225296461  -4.0557147855   0.2724051667
H    5.6858627772  -0.4753290771   0.2342013357
*