! 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  -0.0799150150  -1.2972146466   2.0994969697
Cl   1.3469788671  -5.3201417672  -1.0898406573
O   -0.7964768498   0.8628853363   0.2762953743
O    0.3731190142   1.2427461819  -1.6061410446
N    1.3956563689   2.6250731595   0.6370474650
N    0.8029395082   3.0866846525   1.7419852980
N    1.1425352287   4.7549645676   0.2792389521
C    0.4199695461   0.6079328099  -0.3577559936
C   -1.6046643824   1.7056740259  -0.5387340696
C   -0.9842439268   1.5130671563  -1.9103544299
C   -3.0580207290   1.2994814410  -0.4466454417
C    1.5998167654   1.2188200143   0.4132952301
C    0.6312253252  -0.8949448550  -0.5122710683
C   -3.6502585421   1.4402577997   0.9498520142
C    0.4296107245  -1.8049363880   0.5244997987
C    1.0831058968  -1.4021943528  -1.7263735795
C   -5.1189875281   1.0469660678   0.9893242472
C    0.6442484454  -3.1645947909   0.3554684276
C    1.3077386424  -2.7546154752  -1.9224719462
C    1.5778483805   3.6269593415  -0.2254563568
C    1.0795381374  -3.6269521008  -0.8739393744
C    0.6771527685   4.3604537523   1.4796621892
H   -1.4932343275   2.7482229849  -0.2102777754
H   -1.4425627207   0.6753338120  -2.4487824198
H   -1.0341304026   2.4023026901  -2.5364308496
H   -3.1679352506   0.2688672359  -0.7979672755
H   -3.6192763985   1.9289339272  -1.1444924626
H    2.5177864610   1.0781398761  -0.1562158209
H    1.7324406226   0.7371405276   1.3784703759
H   -3.5377896906   2.4738197192   1.2901170454
H   -3.0864931998   0.8203487154   1.6507611949
H    1.2658618955  -0.7284829898  -2.5509298206
H   -5.5357607029   1.1585857344   1.9905936467
H   -5.7139421059   1.6647315797   0.3141510599
H   -5.2578192294   0.0065081026   0.6897523237
H    0.4744441342  -3.8490173344   1.1747965217
H    1.6554304752  -3.1131497353  -2.8808545662
H    2.0480520851   3.4990447927  -1.1866267879
H    0.2376924952   5.0400531047   2.1926256573
*