! 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  -4.8880176860   1.7586422744  -0.2115544590
F   -2.3603591624  -2.2345217566   1.8472685994
F   -1.1566238088  -2.9763035541   0.2328104080
F   -0.2948089586  -1.6648540123   1.7028631961
O    2.3720859252   1.6568021968  -0.1005644312
N    2.5923848644  -1.1236016808  -0.8202654957
N    0.3432312627  -0.8410725504  -1.0248384005
N    3.9122375510  -2.5801809763  -1.8243865904
C    1.4172493127  -0.4495004985  -0.4840499100
C    1.5651671619   0.6783086490   0.5017847071
C    2.8831378873   2.6160995328   0.8108760750
C   -0.8691333897  -0.2008403578  -0.7815175378
C    1.8482153558   3.6151108636   1.2977872679
C   -1.7801459942  -0.7065165649   0.1525275603
C   -1.2245206396   0.9180871765  -1.5288753557
C   -3.0153525012  -0.0987296222   0.3290592798
C    3.8525366571  -0.9543837248  -0.2774808365
C    2.4827066825   4.6409375123   2.2246852449
C    2.7021381629  -2.1214060312  -1.7501293166
C   -1.4039815407  -1.8962337837   0.9804607967
C   -2.4547587944   1.5261414177  -1.3567761396
C   -3.3438685320   1.0109805392  -0.4285982575
C    4.6398805576  -1.8574252294  -0.9064314956
H    2.0123493507   0.2932731657   1.4286549277
H    0.5755300334   1.0609173563   0.7654290742
H    3.6786678246   3.1386807194   0.2757894064
H    3.3474659106   2.1081175620   1.6671481245
H    1.3978896792   4.1166047245   0.4375297258
H    1.0392365434   3.1031658965   1.8264299172
H   -0.5310121463   1.3114353141  -2.2596165309
H   -3.7220725412  -0.4787749818   1.0528390641
H    4.0804071376  -0.2421827815   0.4947636395
H    3.2824854048   5.1899890718   1.7246668249
H    1.7476517100   5.3695411282   2.5654081137
H    2.9106782767   4.1681013203   3.1103056876
H    1.8615621305  -2.4569121774  -2.3336290549
H   -2.7109216447   2.3960235795  -1.9454052940
H    5.6921502659  -2.0305936279  -0.7504405518
*