! 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  -2.1967252482  -0.0471544992  -2.8182846135
Cl  -3.5182333435   3.5292907016   0.9177348017
F    3.5150711962  -1.2592695524   0.1900812914
F    4.3107756838   0.1296730829  -1.2561134877
F    5.1548547999   0.5209214719   1.3184615943
F    3.0898528515   0.8432296946   1.9584827341
O    2.2088069176   0.3995502748  -0.5487469217
N   -0.8947812226  -2.3933825020   0.6009008026
N   -1.7183282435  -3.0816300055  -0.1913882816
N   -2.7041587463  -2.6468977853   1.7785761545
C    0.1723391698  -0.8561749861  -0.9784974953
C    0.3746612320  -1.8990854461   0.1234576394
C    1.4949930348  -0.3581246110  -1.5400042006
C   -0.7398285587   0.2620435343  -0.5351568052
C   -1.8423615349   0.6737550344  -1.2816900931
C   -0.5228731804   0.9233596817   0.6738517304
C    3.4478285773   0.0370121530  -0.2126489068
C   -2.7023753009   1.6732218033  -0.8491128056
C   -1.3564878414   1.9282814107   1.1306964069
C   -1.4987400041  -2.1311401628   1.7592585171
C   -2.4494110864   2.2900426790   0.3619050066
C    3.9398595939   0.9498264089   0.9098460914
C   -2.7807386903  -3.2122635774   0.5603643783
H   -0.2911692953  -1.3797922076  -1.8164671904
H    0.9550456620  -2.7359886988  -0.2639771599
H    0.9065613567  -1.5041254961   0.9869067585
H    2.0812225340  -1.2052405999  -1.9027652521
H    1.3151291579   0.3056796402  -2.3861656800
H    0.3236848982   0.6571392647   1.2913733719
H   -3.5544515779   1.9596979416  -1.4488835919
H   -1.1526688916   2.4150597254   2.0737119787
H   -1.0224277843  -1.5864154182   2.5589214153
H    4.0055419172   1.9922002837   0.5957313075
H   -3.6530402947  -3.7436326824   0.2138849260
*