! 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 "WATER"
end
*xyz 0 1
Cl  -5.3564519303  -0.8197420916   0.5786449379
O    3.4817096436   0.8709468139   0.4367338797
O    0.3972880555  -0.5959405305  -0.4994980755
N    1.0826376264   1.6217793483  -0.4680334169
N    1.1049847472   1.8292580807  -1.7863677133
N    0.9245894883   3.7749616580  -0.6797709895
C    3.0672234359  -1.5489707957   0.4969275988
C    2.7150142720  -0.1723659377  -0.1246418886
C    1.2737908455   0.3022063331   0.0994264683
C    4.5944237323  -1.6940141000   0.4541397402
C    2.6000191312  -1.6536120345   1.9476301313
C    2.4792029076  -2.7003996236  -0.3237541546
C    0.9859577715   2.7850140106   0.1746569330
C   -0.9275900318  -0.5739603903  -0.1958344527
C    1.0012480828   3.1295348189  -1.8599645677
C   -1.5145446563   0.2609591565   0.7467740581
C   -1.7132554364  -1.4831512555  -0.8992259915
C   -2.8810659906   0.1805380243   0.9834057084
C   -3.0726506621  -1.5626134399  -0.6627114201
C   -3.6521074082  -0.7261977423   0.2807165633
H    2.8874483932  -0.2379024393  -1.2080999589
H    1.0924773601   0.4056292617   1.1751307359
H    4.9895890413  -1.5389616090  -0.5535997239
H    5.1025138596  -1.0040281959   1.1289086141
H    4.8798495216  -2.7022025323   0.7585256479
H    2.9707760061  -2.5771715776   2.3961682817
H    1.5116628935  -1.6781167403   2.0361548246
H    2.9703564084  -0.8269802321   2.5567747160
H    1.3973095169  -2.7784622548  -0.2428887057
H    2.8959219681  -3.6472860706   0.0249970812
H    2.7309702717  -2.6077645902  -1.3828699374
H    4.3606911152   0.8473889573   0.0474808390
H    0.9641552254   2.8642622344   1.2502408888
H    0.9761231116   3.6390850593  -2.8101628022
H   -0.9503493304   0.9836497862   1.3183781905
H   -1.2567956621  -2.1328062088  -1.6346056575
H   -3.3282541606   0.8344227771   1.7192106293
H   -3.6715012977  -2.2747016017  -1.2133911918
*