! 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  -1.7026043464  -0.5941644901  -2.3289180906
Cl  -4.7951543143   3.0552983504   0.0408239311
F    3.9835022362   1.1440326171  -0.9642202492
F    4.0392908847   1.2497597775   1.1904593433
F    4.7434630400  -1.5048455449  -0.8626296291
F    4.8154215273  -1.3844007135   1.3174677553
O    2.6278140448  -0.1817416064   0.2143356967
N   -0.9916577965  -2.1760184416   0.9300779843
N   -2.1643303097  -1.9496093580   1.5280252160
N   -2.3495910033  -3.6262164028   0.0473345061
C    0.2575456691  -0.2386762877   0.0689839649
C    0.1596136453  -1.3285584899   1.1431141494
C    1.4666116860   0.6587081966   0.2934304218
C   -1.0040285901   0.5864917319   0.0268277179
C   -1.9418108419   0.4911326695  -0.9985849128
C   -1.2992349444   1.4634813819   1.0689892233
C    3.8292754643   0.3951420785   0.1580174155
C   -3.1083481958   1.2424639191  -1.0064571339
C   -2.4508625185   2.2286389798   1.0911563763
C   -1.1237551782  -3.1627536844   0.0433951510
C   -3.3480875045   2.1100970260   0.0428937114
C    4.9292070812  -0.6646213949   0.1794844159
C   -2.9388655470  -2.8431171248   0.9699067614
H    0.3998448944  -0.7298448519  -0.8953481553
H    1.0469183321  -1.9591971041   1.1322069442
H    0.0747035294  -0.8967935532   2.1393676524
H    1.4922510607   1.4312934910  -0.4769589035
H    1.4327607528   1.1416466005   1.2717071818
H   -0.6161201955   1.5544967092   1.9039776664
H   -3.8160147070   1.1466318525  -1.8178827510
H   -2.6426933238   2.9004915201   1.9156884163
H   -0.3064355335  -3.5194049537  -0.5635383177
H    5.9248254705  -0.2237308811   0.1224035589
H   -3.9766455039  -2.9392879806   1.2477015671
*
