! 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  -4.8728610890   1.8121076272  -0.0423492637
F   -2.7408962884  -2.7494753824   1.0736642449
F   -1.3353942826  -3.0388930278  -0.5213291677
F   -0.6627210095  -2.3054987301   1.3861358843
O    2.2311326341   1.7245653947   0.5031338068
N    2.6356740766  -1.0338205406  -0.4689238428
N    0.4028644382  -0.7209178146  -0.7493482884
N    4.7785118439  -1.5619473005  -0.5130307955
C    1.4472328995  -0.3949202633  -0.1150142041
C    1.5461569028   0.6082879784   1.0024936678
C    2.4702336162   2.7017722744   1.5010033258
C   -0.8185908701  -0.0988199384  -0.5173974450
C    3.1855679490   3.8829563955   0.8852732003
C   -1.8832955593  -0.8176546697   0.0375474025
C   -1.0326504060   1.2183355668  -0.9151723620
C   -3.1283374405  -0.2255094820   0.1890668342
C    2.7734655477  -2.0370374830  -1.4080795270
C    2.3828766987   4.5891704515  -0.1970139692
C    3.8873341150  -0.7933444032   0.0304926771
C   -1.6584361813  -2.2271399656   0.4910898822
C   -2.2741686736   1.8114775538  -0.7711119450
C   -3.3152152524   1.0830989324  -0.2214641499
C    4.0913495929  -2.3443885676  -1.4135433075
H    2.0648010451   0.1522641964   1.8566261896
H    0.5414225676   0.8692543994   1.3513671142
H    3.0743590354   2.2706340985   2.3097072103
H    1.5198488794   3.0262618779   1.9460882558
H    3.4050837100   4.5808732587   1.6966160540
H    4.1528379308   3.5596099035   0.4913977178
H   -0.2197249197   1.7809581823  -1.3547412375
H   -3.9533153905  -0.7712034637   0.6245966184
H    1.9391898055  -2.4312490361  -1.9597120108
H    2.9141193479   5.4680161222  -0.5630814848
H    2.1940669963   3.9420372318  -1.0534225896
H    1.4163899462   4.9247650881   0.1839316251
H    4.0908874615  -0.0499807771   0.7826738176
H   -2.4207020684   2.8351728947  -1.0866882759
H    4.5897944069  -3.0881653263  -2.0137048732
*