! 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  -4.9171319211   1.6993554964  -0.5722581723
F   -0.9567781592  -2.7471860587   0.3840299848
F   -0.2006476111  -1.2834916835   1.7679803201
F   -2.2411091559  -1.9360502277   1.8985734107
O    2.7077368395   1.6307921689   0.5165620034
N    2.7335393445  -0.7634725825  -1.0520027068
N    0.4728954810  -0.6525324119  -0.9809162283
N    4.8446089212  -1.2488027139  -1.4754069483
C    1.5655654300  -0.0273066880  -0.8460933055
C    1.7437257475   1.4317665947  -0.4786289915
C    2.3635870628   1.1254471372   1.7992697691
C   -0.7678134730  -0.0473877668  -0.8484258474
C    1.2403795991   1.8798319036   2.4891428820
C   -1.6808023445  -0.5233499145   0.1021025572
C   -1.1772291199   0.9596001784  -1.7201230024
C   -2.9527996401   0.0223365162   0.1904866271
C    2.8064748626  -2.1388560035  -1.1634753192
C    1.5247928373   3.3642541848   2.6588146320
C    4.0021695379  -0.2887913896  -1.2517999228
C   -1.2717252022  -1.6220088388   1.0349002035
C   -2.4476412994   1.5004762147  -1.6421625456
C   -3.3266279386   1.0295628583  -0.6825535859
C    4.1077223385  -2.4103817041  -1.4149702170
H    0.7697129063   1.8445747838  -0.2021315604
H    2.0716917965   1.9799536584  -1.3656283753
H    3.2764980232   1.2092062186   2.3912647621
H    2.1214486008   0.0571661029   1.7469210936
H    0.2893237828   1.7365687651   1.9682839370
H    1.1104103486   1.4116011690   3.4680426395
H   -0.4959623444   1.3124297987  -2.4834608373
H   -3.6576456336  -0.3302572015   0.9296891076
H    1.9460870190  -2.7722038554  -1.0404596395
H    1.5856039132   3.8814722725   1.7008332519
H    0.7391320304   3.8481451211   3.2391198269
H    2.4681838177   3.5280005755   3.1834931582
H    4.2505750251   0.7585288841  -1.2443669108
H   -2.7417284891   2.2823407226  -2.3283859128
H    4.5622808437  -3.3774380461  -1.5566589317
*