! 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   0.5384619443  -1.6929398892  -1.8985575473
Cl   4.8838075976   1.0047036111  -0.4081503061
O   -1.3434134532  -1.5025323536   0.3594212460
O   -1.4141976274   0.3315738910   1.6222924317
N   -1.3530496372   1.9248682566  -0.8901873901
N   -0.4553555652   2.2449539738  -1.8277198766
N   -0.8391363368   3.9964476566  -0.4785757211
C   -1.0002394159  -0.1513398182   0.3775844572
C   -1.4449446280  -1.9828939942   1.7011419222
C   -1.1971236774  -0.7269174567   2.5421675647
C   -2.8071791448  -2.6078938782   1.9307579983
C   -1.8035138014   0.5684521336  -0.7128077415
C    0.5003649009   0.0734465323   0.1883190722
C   -3.1066077276  -3.7954387605   1.0258929865
C    1.2490189850  -0.5556037812  -0.8030472807
C    1.1549929721   1.0162747296   0.9755898202
C   -4.4779826934  -4.3939462044   1.3007876156
C    2.5955277779  -0.2822073516  -0.9897737343
C    2.4964033916   1.3146024523   0.8093712346
C   -1.5573891684   2.9723735447  -0.0885932497
C    3.2072934763   0.6542892159  -0.1758712835
C   -0.1847880063   3.4905958337  -1.5415264631
H   -0.6604546855  -2.7261575479   1.8742345354
H   -1.8991556895  -0.6162038900   3.3680743105
H   -0.1805082864  -0.7009471612   2.9462063610
H   -3.5815334434  -1.8412126227   1.8166025416
H   -2.8451351838  -2.9320639340   2.9753782089
H   -2.8593721573   0.5678433685  -0.4423986950
H   -1.6996756855   0.0545987204  -1.6651030517
H   -2.3375278113  -4.5607361988   1.1672722210
H   -3.0474011303  -3.4895718439  -0.0210711026
H    0.6080050740   1.5444526675   1.7438656642
H   -5.2714642010  -3.6677945711   1.1142043282
H   -4.6699684466  -5.2597954424   0.6661809135
H   -4.5695575600  -4.7202153634   2.3385504669
H    3.1531017534  -0.7884724575  -1.7652466466
H    2.9704287226   2.0534904961   1.4397824304
H   -2.2433070520   2.9536152190   0.7429209931
H    0.5127967994   4.0639351965  -2.1314833844
*