! 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   0.2599389365   3.1983796210   2.2274686561
Cl   1.1407666081   4.7636108752  -0.3515873116
F    5.0338999221  -3.3259096856   0.2252195023
F   -1.5764439549  -0.5578027206  -2.6928455001
F   -1.1245284388   1.0257425826  -1.2656820281
O   -1.3907939888  -3.2680652406   0.9069902369
N   -0.1795344558  -1.5540717682   0.0324270459
N   -4.6878149795  -0.8782868730   0.2680478056
N   -4.2123090151  -0.0825405737  -0.6795661685
C    2.1801670177  -1.1149192990   0.1043555256
C    1.1284393722  -2.0446541243   0.1451856884
C   -2.5766793900  -1.4212585963   0.0971167662
C    1.9231916674   0.3407704882   0.0031832900
C   -2.9368745416  -0.3873504853  -0.7993174804
C   -1.3383870034  -2.1683908776   0.3749537962
C   -3.7566074432  -1.7011915730   0.7562918903
C    3.4971390738  -1.5588351966   0.1207629851
C    1.4271114733  -3.4046868123   0.2213500592
C    1.2882349884   1.0223163406   1.0369655995
C    2.3191632101   1.0451381639  -1.1301158134
C    3.7582107014  -2.9094883533   0.2015139377
C    2.7422848834  -3.8389489432   0.2560130429
C   -2.1567436517   0.3263931189  -1.8378197551
C   -6.0739653425  -0.8030670933   0.6792206563
C    1.0461699267   2.3823089745   0.9327554313
C    2.0805870868   2.4040014908  -1.2339788795
C    1.4402016518   3.0764286540  -0.2054441216
H   -0.2471253150  -0.5922379435  -0.2618532721
H   -3.9758852543  -2.4128752446   1.5355955258
H    4.3107453829  -0.8458339710   0.0851578074
H    0.6436280353  -4.1436939977   0.2356067450
H    0.9879749751   0.4974466323   1.9345578608
H    2.8080086220   0.5296911702  -1.9458292562
H   -2.7695602109   1.0266841960  -2.4037661097
H    2.9630148653  -4.8963375324   0.3127067565
H   -6.5588985528  -1.7661501841   0.5417035114
H   -6.1423157295  -0.5117090492   1.7243233410
H   -6.5760958476  -0.0607749613   0.0685135125
H    2.3870302587   2.9422649548  -2.1200573791
*