! 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  -1.3834829871  -0.1861076276  -2.2764341054
Cl  -4.8133289935   3.0154829791   0.2689913157
F    3.1590637953   0.4286946313  -1.4053532890
F    4.1488761121   1.6160954567   0.1014402212
F    4.3458165981  -1.8406727655  -0.4480897325
F    5.3180050676  -0.6808816191   1.1270226443
O    2.7291094306   0.0254675819   0.7521778061
N   -0.9417301695  -2.1400736378   0.7893524637
N   -2.1393494926  -2.0052237119   1.3648028382
N   -2.2514320019  -3.4470170996  -0.3514824247
C    0.3526471464  -0.0950636552   0.3068934159
C    0.1941081752  -1.3408126780   1.1877480863
C    1.5035049522   0.7749566161   0.8021986723
C   -0.9296570230   0.6959540792   0.2632901618
C   -1.7770117267   0.7056304743  -0.8419474072
C   -1.3431500958   1.4218276513   1.3784035684
C    3.6546198678   0.3750440082  -0.1426176418
C   -2.9704987257   1.4121730735  -0.8538339730
C   -2.5246460575   2.1404963909   1.3988840871
C   -1.0292930475  -2.9880881659  -0.2347917400
C   -3.3303190074   2.1279660376   0.2730955085
C    4.8167793427  -0.6157608228  -0.1260306481
C   -2.8834861305  -2.8072659586   0.6495828786
H    0.6027522146  -0.4235272692  -0.7033131390
H    1.0846466949  -1.9648865439   1.1311710606
H    0.0508640155  -1.0670621716   2.2322299575
H    1.5610240963   1.6913157427   0.2135032399
H    1.3738625916   1.0627965827   1.8451845212
H   -0.7333438478   1.4273653948   2.2725845734
H   -3.6057174818   1.4001540274  -1.7283740011
H   -2.8091763048   2.6951180296   2.2817326576
H   -0.1849695257  -3.2525186506  -0.8517958580
H    5.6064156165  -0.3327042302  -0.8227005471
H   -3.9313561013  -2.9435608595   0.8662376199
*
