! 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  -4.9774247206   1.6237383355  -0.5480270586
F   -0.2015774766  -1.2802924219   1.7540994563
F   -2.2233035009  -1.9923241530   1.8653603471
F   -0.9089840476  -2.7473100124   0.3478816863
O    2.7004124249   1.7499416762   0.4604737763
N    2.7230311471  -0.6693814143  -1.0565709417
N    0.4599959822  -0.6102109979  -1.0020450016
N    4.8392565021  -1.1078071439  -1.5067922883
C    1.5378002872   0.0344039336  -0.8390741608
C    1.6546967204   1.4896925458  -0.4296570959
C    2.6066230093   1.1341600275   1.7409762668
C   -0.7938453817  -0.0348725448  -0.8566538782
C    2.0642352037   2.0621694463   2.8106215389
C   -1.6941668770  -0.5409803682   0.0903092104
C   -1.2262494514   0.9754574318  -1.7133207167
C   -2.9772693151  -0.0229257402   0.1888257080
C    2.8208766673  -2.0414013732  -1.1945105645
C    0.6213150758   2.5005153014   2.6067100063
C    3.9819150588  -0.1674304941  -1.2582730124
C   -1.2593769531  -1.6400991820   1.0105472750
C   -2.5071208580   1.4890152402  -1.6250396011
C   -3.3742123167   0.9875586916  -0.6699202323
C    4.1246099102  -2.2840187571  -1.4605964514
H    0.6848238145   1.8048526608  -0.0347567155
H    1.8361423952   2.0904418399  -1.3251129503
H    3.6183889519   0.8213505715   2.0065990227
H    1.9990999812   0.2226863337   1.6981675971
H    2.1502825487   1.5257939061   3.7592649832
H    2.7141104121   2.9368411521   2.8964043820
H   -0.5543976073   1.3543961959  -2.4723821399
H   -3.6726503044  -0.3997881833   0.9251792693
H    1.9732266898  -2.6926344194  -1.0763993164
H    0.2657336777   3.0677889403   3.4671714089
H    0.5048311162   3.1438984476   1.7339491068
H   -0.0437602407   1.6425099803   2.4856421591
H    4.2100480668   0.8838252089  -1.2323735123
H   -2.8188314032   2.2743802559  -2.2993945783
H    4.5961573263  -3.2397119110  -1.6225224726
*