! 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  -1.6944455655   0.6745959653  -3.0596027318
Cl  -3.3250697833   3.3588233777   1.2642867897
F    3.5969592947  -1.0074146986   1.0248674660
F    4.1066160516  -0.6217987170  -1.0345866201
F    5.1500833299   1.1914085523   0.6593260052
F    3.1733028391   1.6486238169   1.4669286595
O    2.0566865562  -0.1032854625  -0.3206000968
N   -1.5099432274  -2.6326649350  -0.0713347518
N   -0.8770694804  -3.2322335682   0.9418876947
N   -2.9554215774  -2.6483069038   1.5536608051
C    0.0355792571  -1.0206419901  -1.1696725700
C   -0.8367756607  -2.2802386007  -1.2981099433
C    1.3246607023  -1.3329429676  -0.4282845254
C   -0.7645602919   0.1074990032  -0.5677552672
C   -1.5977620354   0.9108087111  -1.3438485138
C   -0.7700291246   0.3440782842   0.8052006729
C    3.3528781727  -0.1595822131  -0.0033793522
C   -2.3875649404   1.9119565719  -0.7992208951
C   -1.5483793321   1.3316132110   1.3823720864
C   -2.7356823360  -2.2786562467   0.3153173844
C   -2.3500689568   2.1132855049   0.5686097496
C    3.8331301352   1.2435128634   0.3589182791
C   -1.7838902979  -3.2205471744   1.8850054485
H    0.3162638667  -0.7579499721  -2.1919907681
H   -1.6040943632  -2.1180914045  -2.0529101533
H   -0.2396810431  -3.1294161572  -1.6283590607
H    1.1459775905  -1.7439183703   0.5658245526
H    1.8831507507  -2.0749893181  -1.0034726206
H   -0.1570810588  -0.2583090927   1.4619809103
H   -3.0190043972   2.5185145770  -1.4330856754
H   -1.5242801508   1.4847535199   2.4518997769
H   -3.4341855411  -1.7768189174  -0.3358482833
H    3.6680471080   1.9575660673  -0.4474778361
H   -1.5916678908  -3.6503420940   2.8554652345
*