! 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  -0.2204671097   2.9037292563   1.8636137756
Cl   0.7603496476   4.6224801004  -0.5829646799
F    5.2282716503  -3.2086051564  -0.2077206904
F   -1.5973176365  -0.1996033898   2.4944490403
F   -2.2584108817  -2.2412331823   2.1172726555
O   -0.2171043423  -0.8604549643  -1.9449557294
N   -0.0874627471  -1.8173768971   0.0935749905
N   -4.0785633656   0.1812146655  -0.9902771897
N   -4.0792283916  -0.0554338376   0.3145678829
C    2.2550358376  -1.1580296549  -0.1605689780
C    1.2796843479  -2.1487577113   0.0125486642
C   -2.1138472838  -0.6905459536  -0.5836979708
C    1.9067990148   0.2750568647  -0.2431466690
C   -2.9049652306  -0.5861194750   0.5855365186
C   -0.7405770481  -1.1286905317  -0.8729562110
C   -2.9289055703  -0.1708315953  -1.5695431805
C    3.5908486298  -1.5371525949  -0.2538750534
C    1.6574665458  -3.4800563549   0.1314832914
C    1.1243194178   0.8701902183   0.7396890198
C    2.3517827378   1.0483222424  -1.3107490538
C    3.9332665677  -2.8679276362  -0.1332377549
C    2.9903357967  -3.8530881461   0.0733176665
C   -2.6355688830  -0.9279232247   2.0026298046
C   -5.2090550728   0.8209179522  -1.6282426815
C    0.7687642637   2.2048523971   0.6404535214
C    2.0074634314   2.3846491108  -1.4070319002
C    1.2057625825   2.9663475100  -0.4374218302
H   -0.6115250774  -2.2187039274   0.8548154607
H   -2.7591543378  -0.0394699119  -2.6255489241
H    4.3628357744  -0.7900753474  -0.3875752929
H    0.8981529963  -4.2397005584   0.2632805715
H    0.7909470177   0.2990918240   1.5936142760
H    2.9572895662   0.6046432908  -2.0897247889
H   -3.5094444998  -0.7683308058   2.6326816361
H    3.2811248366  -4.8900698311   0.1714673436
H   -5.4347820618   0.3199610585  -2.5653882367
H   -6.0688317128   0.7472143183  -0.9708101138
H   -4.9941463498   1.8692522526  -1.8230488083
H    2.3506116381   2.9737786044  -2.2460398165
*