! 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  -3.1853856694  -2.1617698967   1.3332553289
Cl  -5.0215587853  -0.6792723007  -0.3449780153
F    3.5587114928  -3.0468108704  -0.7673330655
F    1.7574129261  -2.6666307939   0.4139759682
O    2.3398663390  -0.5418023784   2.6436357003
N    0.9558052395   1.1479899661   2.1028407287
N    3.3232112884   0.8359196854  -1.4758120839
N    3.5449327840  -0.4734522236  -1.3896626493
C   -0.9079633770  -0.2685294333  -0.0088858784
C   -2.3443870158   0.9058502873  -1.3318343480
C   -0.3789979342  -0.5240063906  -1.4466481037
C   -1.3554687695   0.2753735932  -2.3451902700
C   -2.3870344255  -0.2052719861  -0.3094864815
C   -0.6930527081   1.1943328812   0.2989012040
C   -1.5647316120   1.9152993375  -0.5234960055
C    0.1313261547   1.8522359033   1.1938746256
C   -1.6156942215   3.2925131011  -0.4841554806
C   -3.3912497225  -0.9156996858   0.1601658574
C    0.0708851678   3.2463573327   1.2500509418
C   -0.7860905001   3.9537287669   0.4213007525
C    1.9105374427   0.2409765059   1.8019395881
C    2.4703201739   0.2569911633   0.4463909269
C    3.0403323606  -0.8372027845  -0.2314688406
C    2.6778056146   1.3200446752  -0.4098169355
C    3.0456687797  -2.2590027711   0.2090727245
C    3.8028680467   1.5934854167  -2.6119084523
H   -0.5717882078  -0.9818604073   0.7383970895
H   -3.2843716663   1.2526507206  -1.7519537221
H   -0.4181909399  -1.5898823547  -1.6693939323
H    0.6531396169  -0.2030192667  -1.5581834742
H   -0.8581916411   1.0386600310  -2.9427613940
H   -1.8910792678  -0.3829783925  -3.0288941521
H   -2.2943309610   3.8491553361  -1.1172086109
H    0.6978391615   3.7752267226   1.9562504932
H   -0.8165296435   5.0329887260   0.4888135011
H    0.6930868816   1.1951287414   3.0791280129
H    2.4379102354   2.3671812037  -0.3231021984
H    3.6047779308  -2.4352116094   1.1256947705
H    4.6932823236   2.1590814962  -2.3482893572
H    3.0309675687   2.2779958084  -2.9511073570
H    4.0406798340   0.9037906053  -3.4142349079
*