! 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   0.3288922585   0.3550321991  -1.9416540889
Cl   3.8169526807   2.6598696494   1.3380634347
O   -1.9754635425  -0.4211847582  -0.3854704512
O   -1.9769050253  -0.5133438142   1.8393832422
N    0.0604460493  -2.5756338323  -0.3752846689
N   -0.4331015082  -2.9259794178  -1.5660010379
N    1.8115950264  -2.9315966613  -1.6124968690
C   -1.1699060396  -0.7136543996   0.7128859018
C   -3.0218290628   0.4635425640   0.0218531553
C   -2.7928250099   0.6034418129   1.5281002358
C   -0.7873297577  -2.1979916756   0.7232976127
C    0.0762278323   0.1747606892   0.7890624794
C   -2.9838978913   1.7764049542  -0.7337404225
C   -4.1402031951   2.6792378183  -0.3257176701
C    0.7855283218   0.6710675201  -0.3042263567
C    0.5869631338   0.4576436980   2.0553501112
C    1.9318103240   1.4401429188  -0.1396300744
C    1.7284571966   1.2142759181   2.2466619250
C    1.3941341316  -2.5736574485  -0.4237961135
C    2.3903480978   1.7075322095   1.1360105557
C    0.6512743446  -3.1286573331  -2.2665543518
H   -3.9736987592  -0.0407443366  -0.1759213737
H   -2.2829085451   1.5422794223   1.7769772499
H   -3.7072092174   0.5407166532   2.1147711521
H   -1.6907366377  -2.8060590883   0.6887442036
H   -0.2644365677  -2.4276598171   1.6518177834
H   -2.0305227136   2.2808708471  -0.5512829729
H   -3.0367268014   1.5755072177  -1.8058762181
H   -4.1369592429   3.6011385098  -0.9064756933
H   -5.1030646088   2.1918363707  -0.4899764643
H   -4.0885144691   2.9613150465   0.7278103697
H    0.0778295903   0.0775723178   2.9299707886
H    2.4576060787   1.8172559874  -1.0056200531
H    2.0884348062   1.4126815951   3.2459010163
H    2.0127282397  -2.3337285207   0.4269512611
H    0.6044096144  -3.4408124568  -3.2982320908
*
