! 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   0.0884290396  -0.2515504406  -2.7019224168
Cl   4.1821688984  -2.0445886784   0.1973246328
O   -2.2232632918  -0.1526903607  -0.8550538022
O   -1.9252414576   0.3309877634   1.2893560816
N   -0.1475724730   2.5567826737   0.4173747134
N    1.0817355249   2.6878876370  -0.0911493393
N    1.0623561594   3.2701890912   2.0758004535
C   -1.3268819062   0.4416819919   0.0270411274
C   -2.7647734173  -1.2841632294  -0.1827728879
C   -2.6734152075  -0.8787541917   1.2987503960
C   -1.2056166202   1.9269409710  -0.3293116614
C    0.0409621443  -0.2407641003   0.0319933586
C   -4.1708105799  -1.5559151795  -0.6734341569
C   -4.7627721731  -2.7915140405  -0.0114693859
C    0.7406390277  -0.5615777609  -1.1285926957
C    0.6761561283  -0.4874155429   1.2455039720
C    2.0077126855  -1.1228167693  -1.0882647002
C    1.9437676608  -1.0389445800   1.3172255574
C   -0.1373476959   2.8920155102   1.7093074700
C    2.5984051176  -1.3551258070   0.1411158744
C    1.7637260930   3.1203886104   0.9357733875
H   -2.1334126928  -2.1605127560  -0.3752781784
H   -3.6507814282  -0.6689272588   1.7383102062
H   -2.1806953295  -1.6445405733   1.9019873996
H   -2.1497337357   2.4285430302  -0.1175966818
H   -0.9881550115   2.0510306710  -1.3872320085
H   -4.1526857618  -1.6969646339  -1.7565335996
H   -4.7978557998  -0.6832454841  -0.4710357659
H   -4.1625925570  -3.6794505486  -0.2156784975
H   -4.8323644914  -2.6817671966   1.0723560597
H   -5.7696862308  -2.9827692705  -0.3808063199
H    0.1756722839  -0.2380714058   2.1702138422
H    2.5262932503  -1.3664132009  -2.0047972554
H    2.4062952120  -1.2139215840   2.2781968926
H   -1.0169471395   2.8661924767   2.3321897548
H    2.8157547296   3.3450097140   0.8573110806
*
