! 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  -0.4264783409   0.5276273327  -2.1997618560
F    5.2242514896  -0.8629749557  -0.1028355600
O   -0.3247417447  -0.0594796151   2.3210825903
N   -3.3592748258  -2.0758550627   0.6229343793
N   -1.7658295877  -3.0163001716  -0.8440894391
C   -0.2452787067  -0.0005701564   0.9100028885
C    1.2144470590  -0.2253808766   0.5320583109
C   -0.8129443645   1.3269760038   0.3907367431
C   -1.1901819148  -1.1016941614   0.4469553861
C    2.0151913703   0.7733453316  -0.0083048025
C    1.8112687553  -1.4371876568   0.8831607939
C   -0.9582921742   1.6258982112  -0.9663935511
C   -1.2698901564   2.2819535787   1.2960259421
C   -2.4760915316  -1.1501228859   0.9703522517
C   -0.8921246932  -2.0818723165  -0.4848969390
C    3.3705301801   0.5674500319  -0.2267764456
C    3.1586164590  -1.6660030245   0.6641184464
C   -1.5244401278   2.8151291553  -1.3996600299
C   -1.8347125607   3.4776163175   0.8779189902
C    3.9161384608  -0.6532091785   0.1082132119
C   -1.9654602906   3.7463056930  -0.4738419670
C   -2.9545579022  -2.9673875085  -0.2688402705
H    1.6024202762   1.7409732022  -0.2587891740
H    1.2249453861  -2.2244955280   1.3398552916
H   -1.1974171355   2.0910967487   2.3567224169
H    0.3434520146   0.5273446216   2.6959093050
H   -2.8144195056  -0.4142326559   1.6908140779
H    0.0768262254  -2.1303876831  -0.9641943950
H    3.9869993497   1.3504333392  -0.6483066728
H    3.6113363513  -2.6118126779   0.9311254948
H   -1.6202814207   3.0104016310  -2.4591372495
H   -2.1758280660   4.1924233926   1.6145742722
H   -2.4077990550   4.6724428428  -0.8146690793
H   -3.6686435356  -3.7296356616  -0.5549329093
*