! 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  -4.4448498712   1.8894496625   0.9585338264
F   -2.0463657651  -1.1375932045  -2.4382108871
F    0.0581734568  -0.9058707716  -2.1035678346
F   -1.0110442158  -2.5058100190  -1.1478030533
O    1.3871289141   1.9003907168   0.6424584984
N    2.9155477311  -1.4411059604   0.6839741845
N    0.7120404032  -0.9437469135   0.6460542213
N    4.9331322709  -2.3330350160   0.7953285361
C    1.8866071938  -0.4882692137   0.7110816833
C    2.3762438399   0.9426379259   0.8247579145
C    1.1177189112   2.2160844923  -0.7136239767
C   -0.4677492603  -0.2258653338   0.7185156309
C   -0.0588383235   3.1650126439  -0.7732448969
C   -1.3988325781  -0.3392639688  -0.3216856229
C   -0.8235709571   0.4983859361   1.8556190891
C   -2.6197465576   0.3208875555  -0.2505534910
C    2.7529653960  -2.8030131141   0.5257312539
C   -0.4363217160   3.4895215279  -2.2096013604
C    4.2569877685  -1.2270764387   0.8437724509
C   -1.0972580782  -1.2167620328  -1.4993349816
C   -2.0438324901   1.1373693654   1.9402107114
C   -2.9285413698   1.0604012845   0.8752210879
C    4.0003111913  -3.3245846472   0.5958260570
H    3.2030140704   1.0847015568   0.1182287856
H    2.7909939303   1.0706408692   1.8294529354
H    0.8981538102   1.3115889183  -1.2920098135
H    2.0042333188   2.6748335544  -1.1709438750
H   -0.9137692772   2.7143176319  -0.2641308877
H    0.1846420969   4.0839325106  -0.2341410776
H   -0.1352912218   0.5558574728   2.6876617249
H   -3.3340620451   0.2569060574  -1.0587048294
H    1.7892644251  -3.2531317804   0.3691777707
H    0.3938495762   3.9447462357  -2.7517766825
H   -0.7348975931   2.5920020981  -2.7539085888
H   -1.2729637950   4.1867234630  -2.2445460943
H    4.6842354144  -0.2505923631   0.9987977881
H   -2.2951118540   1.7014937016   2.8275717350
H    4.2856223532  -4.3601555346   0.5081803855
*