! 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  -5.6848011234  -0.0991966737   0.2435532798
O    1.9559774867  -2.3894546937  -0.7821386698
O    0.0365221327  -0.5969367444  -0.9180340235
N    1.2269760072   1.0964345499   0.1340167752
N    1.1504799570   1.7168078124   1.3164312928
N    1.6091465712   3.1850862392  -0.3155991814
C    3.5956629097  -0.9381090336   0.3265916891
C    2.3136372417  -1.0488972841  -0.5388802485
C    1.0580975931  -0.3346113082   0.0055948447
C    4.6513862025  -1.8552215886  -0.3043757324
C    4.1722642406   0.4818664078   0.3263571565
C    3.3490608493  -1.3787600593   1.7714228548
C    1.5021724297   1.9838606799  -0.8262323789
C   -1.2683520245  -0.4491392317  -0.5656625086
C    1.3903212435   2.9614948628   0.9960870072
C   -1.7128923712   0.0332773279   0.6592623192
C   -2.1923984801  -0.8231830993  -1.5386618806
C   -3.0765208422   0.1371307162   0.9045964644
C   -3.5484531713  -0.7189049741  -1.2931108480
C   -3.9854290190  -0.2364676919  -0.0675005194
H    2.5417557154  -0.6200774467  -1.5219930850
H    0.8072876617  -0.7104012324   1.0021104776
H    4.8130754134  -1.6147428985  -1.3577157464
H    5.6049467674  -1.7258724208   0.2095394624
H    4.3901373842  -2.9109583152  -0.2393976963
H    5.1823765827   0.4597125485   0.7391442860
H    3.6089479820   1.1792790730   0.9441339386
H    4.2467505841   0.8929927815  -0.6825389333
H    4.2900510354  -1.3844042869   2.3239146169
H    2.9408844995  -2.3903133851   1.8454806171
H    2.6733252700  -0.7068840519   2.3035585256
H    1.9126418622  -2.8634218420   0.0563573816
H    1.6081379372   1.7243868554  -1.8675320221
H    1.4020419199   3.7436937868   1.7382560522
H   -1.0335836722   0.3446689628   1.4399119347
H   -1.8449887519  -1.2027482084  -2.4907693412
H   -3.4141503267   0.5170919190   1.8589417135
H   -4.2559358711  -1.0155933475  -2.0551606292
*