! 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  -1.6289819151   0.0845444590  -2.9350260516
Cl  -2.6927403619   3.7062806212   0.8440756903
F    3.8787895106   0.5170810429  -1.3497930773
F    2.1733608448   1.5840143442  -0.5712500605
F    4.6323638585  -0.1881819258   1.1889680992
F    2.8901532723   0.8491446018   2.0021416158
O    2.3299917004  -0.6169796317  -0.2127749530
N   -1.2404899038  -2.7342943589   0.6832773572
N   -1.6346723841  -2.4717930571   1.9308864289
N   -3.3574373070  -3.2284075899   0.7093284593
C    0.1166526406  -1.3596365949  -0.8432092130
C    0.1034606910  -2.4537598484   0.2253814703
C    1.5356593222  -1.0762769724  -1.3163870085
C   -0.5972066299  -0.0999464996  -0.4226364947
C   -1.4036745693   0.6216452024  -1.3004655618
C   -0.4475285605   0.4212203058   0.8607877394
C    2.9937340563   0.5337055173  -0.3192575688
C   -2.0546253219   1.7880795323  -0.9285124493
C   -1.0771483753   1.5854869021   1.2636030438
C   -2.2754520065  -3.1752191340  -0.0300838136
C   -1.8829345106   2.2574708892   0.3608537706
C    3.7618870593   0.8223136200   0.9693482238
C   -2.9031644757  -2.7892218213   1.8965964286
H   -0.3809115521  -1.7734290757  -1.7235759213
H    0.5337594923  -3.3631521152  -0.1942813447
H    0.6894043911  -2.1975952523   1.1040771149
H    1.9954435119  -1.9905477744  -1.6933568765
H    1.5131184115  -0.3552151244  -2.1345099525
H    0.1707596166  -0.0927673743   1.5828578560
H   -2.6812729954   2.3161383016  -1.6334561730
H   -0.9403773207   1.9570773818   2.2692427561
H   -2.1986527572  -3.4576674635  -1.0685333684
H    4.3023712921   1.7679918581   0.9212453245
H   -3.5298048349  -2.6977208087   2.7697049533
*