! 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   0.0483328492   0.6704033219  -2.2025334218
Cl  -1.7046211795   5.0639060296   0.2058056915
O   -0.1450263374  -1.0337027228   2.0636593063
N   -0.7369552980  -3.0219719405  -0.0587383071
N   -0.6027714495  -3.7067158786   1.0832096674
N    0.0398143288  -4.9625726186  -0.6561423826
C   -0.0629732727  -0.7575742932   0.6808161825
C    1.3707108994  -1.0480716909   0.1995202170
C   -1.1046841027  -1.6249701786  -0.0602184304
C    2.4061956081  -0.0565638247   0.7148141660
C   -0.4650380901   0.7070836114   0.5070588912
C    3.8372102644  -0.4563193581   0.3672819327
C   -0.4513370137   1.4002711166  -0.7063365637
C   -0.8842633342   1.4349374981   1.6208150497
C    4.1297006156  -0.4496743077  -1.1260767865
C   -0.8305194161   2.7312022624  -0.8080803985
C   -1.2642053291   2.7640967463   1.5509879986
C   -0.3363902521  -3.7777816038  -1.0784203187
C   -1.2347979240   3.4059117285   0.3277868391
C   -0.1368566869  -4.8593174514   0.6714871905
H    1.4056278967  -1.1001883960  -0.8875744321
H    1.6405070778  -2.0492520163   0.5533019849
H   -1.2137351673  -1.3313998085  -1.1006769092
H   -2.0786956105  -1.5117709986   0.4166615186
H    2.2103393555   0.9391197072   0.3053508293
H    2.3124593721   0.0323659326   1.7997714877
H    4.0505779290  -1.4467208207   0.7804369947
H    4.5218654355   0.2335872076   0.8668065549
H   -0.0746965701  -1.9931901082   2.1780240452
H   -0.9162021912   0.9560601209   2.5864248958
H    5.1805462181  -0.6658630892  -1.3217982584
H    3.5432555554  -1.1939979183  -1.6659174264
H    3.9064454222   0.5245614410  -1.5652924113
H   -0.8051865206   3.2298786766  -1.7665488517
H   -1.5770970045   3.2830637111   2.4456370179
H   -0.3483565933  -3.4367065843  -2.1011026934
H    0.0766496522  -5.6604990250   1.3607010771
*
