! 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  -2.0239116684  -1.6509386906   2.0471272017
Cl  -4.0460620646   2.3783068855  -0.9660644282
O   -0.2131101089  -1.9584621469  -0.0819659851
O    2.5104755203  -1.0850387678  -2.1505714162
N    2.1116731749  -0.5634865798   0.0356683263
C    0.7840620010  -2.2900058994  -1.0324450698
C   -1.0706311638  -0.9525582449  -0.3547033818
C    1.8858290261  -1.2314948520  -1.1130661762
C    1.3760125418  -3.6243606908  -0.6179502720
C   -2.9819439031   0.3315608075   0.4854352536
C   -2.0328558543  -0.6796788339   0.6188492470
C   -1.0564448683  -0.1838682770  -1.5101335520
C    3.0327512647   0.4579865353   0.3057522097
C   -2.9247413339   1.0829571962  -0.6903012356
C   -1.9831705681   0.8315947062  -1.6709004852
C   -3.9906572736   0.5632748020   1.5655203357
C    3.9557497762   0.9499606918  -0.6163140646
C    2.9956962621   1.0021229180   1.5912762506
C    4.8168353035   1.9731189094  -0.2408875273
C    3.8615752475   2.0195798469   1.9508719741
C    4.7802525955   2.5147743611   1.0343790396
H    0.3512982344  -2.3873256230  -2.0326059271
H    1.8074005990  -3.5826303043   0.3819819436
H    2.1577541811  -3.9157184374  -1.3173988803
H    0.6075682357  -4.3958343000  -0.6353532137
H    1.5272366353  -0.8187854891   0.8192702717
H   -0.3407797538  -0.3517412932  -2.3023934780
H   -1.9608430983   1.4273565547  -2.5723934170
H   -3.5033728806   0.7948389608   2.5129000717
H   -4.6000714036  -0.3268599591   1.7245901142
H   -4.6607716256   1.3839000809   1.3291739763
H    4.0153807570   0.5530564971  -1.6156992084
H    2.2814658553   0.6264272988   2.3148100525
H    5.5272432374   2.3465264422  -0.9666656180
H    3.8142548787   2.4263363327   2.9521953674
H    5.4577023371   3.3109129963   1.3117899394
*
