! 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  -1.3070573438  -0.3329652489  -2.1123248565
Cl  -4.7325047761   3.2195526474  -0.0819808047
F    3.0016003977   0.0618192651  -1.0419337328
F    4.1393010128   1.3532593812   0.2557134289
F    5.5325367487  -0.7891792456  -0.6162675034
F    4.0298597537  -2.1504727872   0.1964823485
O    2.6281013440  -0.0129408343   1.1655394651
N   -0.9970174106  -2.1546380969   0.8923402946
N   -0.6562709913  -3.0748397030  -0.0128839175
N   -2.8878843614  -2.9771006780   0.2051052890
C    0.2766771146  -0.0805287008   0.5537236842
C   -0.0151240624  -1.2720002771   1.4742937117
C    1.4225098984   0.7660257219   1.1033139456
C   -0.9639262104   0.7549766930   0.3621811174
C   -1.7406124359   0.7041863369  -0.7942605827
C   -1.4190022828   1.5826274241   1.3877833071
C    3.5414413915   0.1366861950   0.2003930485
C   -2.8961688496   1.4565011213  -0.9441290866
C   -2.5680251984   2.3448372657   1.2709901919
C   -2.3244910790  -2.0977464358   0.9975477463
C   -3.2958081256   2.2764647530   0.0951799366
C    4.6116536458  -0.9413638579   0.3613996259
C   -1.8189530405  -3.5386094309  -0.3885776194
H    0.5894984737  -0.4748153645  -0.4132206768
H    0.8867949718  -1.8531191830   1.6557073919
H   -0.3909087778  -0.9349582531   2.4405490646
H    1.5545810822   1.6662745960   0.5013482897
H    1.2357390999   1.0831109084   2.1287066333
H   -0.8689996291   1.6372341868   2.3184240705
H   -3.4732054687   1.3966972668  -1.8561616583
H   -2.8870906710   2.9771246607   2.0874408716
H   -2.8314961378  -1.4266721916   1.6734228509
H    5.0988324915  -0.8971606963   1.3351679032
H   -1.9000746976  -4.3258601395  -1.1216446641
*