! 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  -1.5574788499   0.3758121407  -2.8696939104
Cl  -1.3726152702   4.9536851419  -0.1201573876
F    3.2574766533  -0.6475233035  -0.9684901487
F    1.8553656259   0.9889621710  -0.8771257204
F    3.6877941621  -0.4366818697   1.7487964616
F    2.2681279190   1.2216311838   1.8324528734
O    1.4300984223  -0.8762793679   0.2876772685
N   -1.3251334527  -3.1568724447   1.0079047460
N   -0.6023637302  -3.9138785095   1.8371675995
N   -1.7547768367  -5.2021444294   0.4071152055
C   -0.9188116352  -1.0608041925  -0.2292996178
C   -1.3206778668  -1.7107904629   1.0962224593
C    0.4994375601  -1.4278604012  -0.6547470151
C   -1.0864884126   0.4374490170  -0.1919428664
C   -1.3465422530   1.1758030703  -1.3452436301
C   -0.9124554986   1.1590574294   0.9853833728
C    2.3671152411  -0.0316483153  -0.1459429638
C   -1.4398410758   2.5576632870  -1.3404153365
C   -0.9992610175   2.5401825191   1.0269389232
C   -1.9993019391  -3.9368879284   0.1639404068
C   -1.2615551924   3.2285511277  -0.1432088259
C    3.1361279610   0.5669015202   1.0303343717
C   -0.8980946866  -5.1244407267   1.4400271556
H   -1.5765114821  -1.4620623813  -1.0049792546
H   -0.6361926307  -1.4633303730   1.9038144463
H   -2.3134574758  -1.3686253883   1.3893372629
H    0.6408779363  -2.5098899585  -0.6619027510
H    0.6879752929  -1.0770104554  -1.6700714662
H   -0.7070458327   0.6443117160   1.9128935180
H   -1.6462422785   3.0972547472  -2.2538129982
H   -0.8587401954   3.0643217709   1.9614762317
H   -2.6621386508  -3.5543331994  -0.5958066195
H    3.9169580995   1.2523224347   0.6993857533
H   -0.4697230418  -5.9923810831   1.9151473541
*