! 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   0.0428018111  -0.9245220407   2.2114324313
Cl   0.1349704692  -5.1511392276  -1.0257036039
O   -0.5613147102   1.3516292517   0.3817236834
O    0.4537588458   1.4690639801  -1.5965917378
N    1.8991033974   2.6578179266   0.5696059240
N    1.5913688248   3.1574640841   1.7693492524
N    1.9878188565   4.8132753532   0.3074339305
C    0.5120085386   0.8458857929  -0.3445388907
C   -1.6210964935   1.6372961487  -0.5267911143
C   -0.8867035288   1.8551767339  -1.8570046180
C   -2.6665256717   0.5364756680  -0.5992669134
C    1.8416255490   1.2464421537   0.3011439718
C    0.4398926675  -0.6743661994  -0.4858153802
C   -3.3839931040   0.2662720927   0.7153001174
C    0.2088873394  -1.5241865885   0.5951951520
C    0.6092152462  -1.2651779021  -1.7336951039
C   -4.4016557326  -0.8569494891   0.5874665908
C    0.1124183290  -2.8979212611   0.4391927788
C    0.5218710028  -2.6349496068  -1.9190803416
C    2.1197623874   3.6541700252  -0.2894518212
C    0.2638998827  -3.4404064902  -0.8248400433
C    1.6633579278   4.4451191994   1.5613866489
H   -2.0911799357   2.5601031130  -0.1787475346
H   -1.3127362822   1.2495383412  -2.6617737427
H   -0.8933860169   2.8987411100  -2.1732221264
H   -2.2141060371  -0.3879605247  -0.9735308768
H   -3.3974800106   0.8420719073  -1.3551031871
H    2.6513348023   0.9753937437  -0.3757883423
H    2.0108975143   0.7203736270   1.2365403014
H   -3.8836544972   1.1797940747   1.0515802608
H   -2.6568672500   0.0095904767   1.4885031068
H    0.8088428430  -0.6433427667  -2.5945941754
H   -5.1492955526  -0.6332776468  -0.1759395356
H   -3.9197023613  -1.7961092431   0.3085749895
H   -4.9308169541  -1.0261364069   1.5258314284
H   -0.0766675468  -3.5316118195   1.2942663915
H    0.6511742478  -3.0595123030  -2.9045599177
H    2.3950568559   3.4961528170  -1.3193744322
H    1.4807412119   5.1533464563   2.3541701744
*