! 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   1.5434033665  -0.5409994229   2.3234690104
Cl   4.1327855465  -3.4839012374  -1.2812877141
O   -1.3039971486   0.3562155873  -1.0655478723
O   -1.1131680451  -0.0922337253   1.1251577011
N   -0.8625499155   2.6677307608   0.5222478643
N   -1.4508032290   3.4398545254  -0.3950474958
N   -2.4490968672   3.6909045745   1.5985008387
C   -0.3955921808   0.3166495678  -0.0128353200
C   -2.3528800345  -0.5610625345  -0.7654476116
C   -2.4390025270  -0.4299700714   0.7447134833
C    0.1721034510   1.7277310730   0.1847226471
C    0.7455248132  -0.6584124274  -0.2936989884
C   -3.6061139801  -0.2250612851  -1.5476256474
C   -4.1032632659   1.2069918117  -1.4164448434
C    1.6475033340  -1.0824762135   0.6814722409
C    0.9382420949  -1.1337983702  -1.5870536193
C    2.6897447488  -1.9485746061   0.3873140412
C    1.9656721349  -2.0048365664  -1.9080834810
C   -1.4731300561   2.8217282207   1.6987868039
C    2.8360448147  -2.4051171592  -0.9105756799
C   -2.3891838237   4.0306880554   0.2961866937
H   -2.0365300466  -1.5795146902  -1.0260633578
H   -3.1322322477   0.3559662681   1.0615119570
H   -2.7316615501  -1.3633307924   1.2259409774
H    0.6608376563   2.0651506973  -0.7271778975
H    0.9207023094   1.7304504347   0.9744981250
H   -4.3796701689  -0.9233234302  -1.2177674203
H   -3.4295424847  -0.4555995141  -2.6007741075
H   -3.3877039752   1.9237788912  -1.8147084271
H   -5.0343663587   1.3272098204  -1.9705609154
H   -4.3076505392   1.4863521647  -0.3822050324
H    0.2682386960  -0.8189844688  -2.3744832416
H    3.3752583852  -2.2591616586   1.1632612124
H    2.0811116134  -2.3589086017  -2.9227114464
H   -1.1650822031   2.3087495268   2.5953106339
H   -3.0568403005   4.7470652295  -0.1559163818
*
