! 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  -0.7452762632  -1.2281255699  -2.6950704220
Cl  -4.3659925530   1.0121756759   0.5645843144
O    0.6297265694  -2.9985536716   0.6157332300
N    1.5871094795  -2.2381645640   0.0124233794
N    1.7915569745   3.2321731582   0.6262008232
C    2.1260956700  -0.1486351313  -0.9988452365
C    1.1582594736  -1.0979821480  -0.3538452649
C   -0.2229191144  -0.6165190260  -0.1205036785
C    2.3908382928   1.0194919418  -0.0882997787
C   -1.1669456121  -0.6023125222  -1.1389766614
C   -0.5946677054  -0.1189973405   1.1241000581
C    3.3589955257   0.9562720076   0.9058015706
C    1.6372316123   2.1839662159  -0.1738351643
C   -2.4457042806  -0.1051499063  -0.9462399738
C   -1.8642251334   0.3846800559   1.3475047141
C   -2.7770553914   0.3853399617   0.3053288175
C    3.5354412807   2.0439349419   1.7448750396
C    2.7271829080   3.1550628866   1.5659041977
C    1.1880399740  -4.2200466096   1.0661596911
H    3.0534616421  -0.6769887791  -1.2216748284
H    1.7150539780   0.2050876411  -1.9474399621
H    0.1225268215  -0.1175091947   1.9336360157
H    3.9711787758   0.0699804194   1.0190241401
H    0.8728939402   2.2748068787  -0.9388336508
H   -3.1646754132  -0.1054566982  -1.7530433102
H   -2.1331617857   0.7699022856   2.3204673821
H    4.2845116213   2.0345502314   2.5241491130
H    2.8412316748   4.0195322543   2.2089486468
H    1.9727676538  -4.0591020378   1.8079848289
H    1.5895248323  -4.8133957830   0.2418586730
H    0.3725498268  -4.7697677759   1.5311467395
*
