! 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  -0.1226309657  -1.0720953205   2.2670906388
Cl   0.5616531235  -5.2491548204  -0.9634828270
O   -0.7484522268   1.1897001064   0.4418238984
O    0.3419115130   1.3584518047  -1.5128056505
N    1.7076034190   2.6528863098   0.5853733886
N    1.2199328665   3.3043932083   1.6441975238
N    1.9174475930   4.7564983615   0.0814441319
C    0.3823768476   0.7539899723  -0.2459364037
C   -1.7269555445   1.5974366954  -0.5108747215
C   -0.8496016859   2.1228904362  -1.6371652050
C   -2.6501426989   0.4667334970  -0.9424044248
C    1.6553158252   1.2203990765   0.4741127064
C    0.4220781079  -0.7658427470  -0.3990642163
C   -3.4372862327  -0.1832015406   0.1902944149
C    0.2011516742  -1.6403553572   0.6634077521
C    0.7150584088  -1.3318364399  -1.6365576917
C   -4.4528926618   0.7454456521   0.8412707203
C    0.2378681845  -3.0172303185   0.4993214526
C    0.7644904329  -2.7017993137  -1.8281830177
C    2.1064909703   3.5295698148  -0.3375386876
C    0.5170952413  -3.5353824040  -0.7522894211
C    1.3738478997   4.5544894756   1.2967143377
H   -2.3014998711   2.4025290617  -0.0494506804
H   -1.2791242100   1.9622300350  -2.6266548318
H   -0.6298536989   3.1883755064  -1.5220649894
H   -2.0777634292  -0.2967067223  -1.4774938574
H   -3.3488147948   0.8855692510  -1.6736869576
H    2.5233437530   0.8824012095  -0.0909443718
H    1.7295601789   0.7964743319   1.4723651521
H   -2.7508230034  -0.5703948083   0.9465621304
H   -3.9595182468  -1.0534759115  -0.2136145859
H    0.9037979755  -0.6902230628  -2.4846288415
H   -3.9823462933   1.6062812650   1.3189680295
H   -5.1654550163   1.1264888429   0.1069474523
H   -5.0232714363   0.2248358812   1.6113766445
H    0.0526235417  -3.6709934333   1.3400983948
H    0.9903895180  -3.1056013290  -2.8049522644
H    2.5447393497   3.2359714254  -1.2776475280
H    1.0865630573   5.3605787230   1.9532035959
*