! 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  -1.0667265753   0.9209629837  -3.0727982369
Cl  -2.9109381000   3.5325441656   1.2043567990
F    2.0907941425   0.2852889691   1.4532312058
F    3.5590995285  -1.2295001433   1.0038035158
F    4.5549054809   1.2864169053   0.9743000263
F    3.1006351380   1.8884649600  -0.5409103134
O    2.0947824458  -0.6437069361  -0.5797556230
N   -1.7471602312  -2.8535672374  -0.0393968144
N   -1.0833877475  -3.5151252845   0.9126757470
N   -3.1426693950  -2.9769030041   1.6232723802
C   -0.1257890885  -1.2905781859  -1.1197309754
C   -1.1119676513  -2.4552130359  -1.2711293836
C    1.1320783189  -1.6892178937  -0.3628699247
C   -0.7987427115  -0.0671676387  -0.5500690583
C   -1.2644831933   0.9732009137  -1.3505709351
C   -1.0329975706   0.0471473035   0.8190407141
C    2.8400768873  -0.2222279921   0.4425666017
C   -1.9023858432   2.0884324351  -0.8291665217
C   -1.6823215386   1.1359789448   1.3728164378
C   -2.9607611287  -2.5285423004   0.4040406355
C   -2.1064164448   2.1553574907   0.5378097719
C    3.8112698925   0.8423881229  -0.0641618912
C   -1.9613016267  -3.5650024174   1.8823387815
H    0.1946889822  -1.0845751645  -2.1431448532
H   -1.9009054261  -2.1703167324  -1.9649265615
H   -0.6054713005  -3.3199019172  -1.6982600314
H    0.9540474255  -1.8585444343   0.6978413254
H    1.5371440275  -2.6129258960  -0.7787404985
H   -0.7025513226  -0.7319156544   1.4935486775
H   -2.2375290236   2.8840533566  -1.4794512475
H   -1.8474044940   1.1835696200   2.4400478894
H   -3.6759870614  -1.9851533117  -0.1927448977
H    4.4688428084   0.4600937004  -0.8454410347
H   -1.7385825772  -4.0540907579   2.8174895989
*
