! 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  -6.0152376080  -1.3532723400   1.9713999881
F    1.3343505565  -2.7909069271   0.8279549957
F    3.2753206741  -2.0998440761   0.2944536528
F    2.1461307882  -1.1169513832   1.8644601032
O    3.9213476275   0.4706097990   0.5855033264
O   -1.8305459433  -0.7245626157  -2.0823961988
N    2.3257739179   2.9155785221   0.0951475161
N    2.2225225537   2.5733846081   1.3852846749
N    0.3770376293   3.6506590169   0.7196681078
C    3.4653196871   0.8634343181  -0.6852235066
C    2.0850193129   0.2875338134  -1.0316798316
C    3.4112353362   2.4101212177  -0.7133850431
C    4.4980903205   0.4005565174  -1.7055012220
C    1.4297586465  -0.7758954855  -0.3864569623
C    1.4085669511   0.8900369148  -2.0924937516
C    0.1197414841  -1.1007316856  -0.7323878583
C    0.1133956763   0.5676432991  -2.4482265034
C   -0.5438840267  -0.4113126214  -1.7312487202
C    2.0616590346  -1.6752017308   0.6511928217
C    1.2126430080   3.5375103052  -0.2868382785
C    1.0427572796   3.0374752442   1.7123964164
C   -2.7711100343  -0.8572061349  -1.0938407442
C   -3.7583412113  -1.8124645374  -1.2842322910
C   -2.7824964721  -0.0454432111   0.0336967382
C   -4.7653401545  -1.9605939089  -0.3439608658
C   -3.7834838512  -0.2013139802   0.9794939221
C   -4.7673123099  -1.1581827454   0.7859362321
H    4.3570621601   2.7940323092  -0.3304169993
H    3.2903211072   2.8111420955  -1.7159809612
H    4.6279371941  -0.6800769322  -1.6591263674
H    4.1936368128   0.6566953903  -2.7194711882
H    5.4648736818   0.8695111501  -1.5149062072
H    1.8965072455   1.6642943724  -2.6685516115
H   -0.3971216473  -1.9060454227  -0.2298073187
H    3.4262178318   0.9730607138   1.2525628671
H   -0.3762368767   1.0827667800  -3.2637947703
H    1.0612288396   3.9070028056  -1.2883533272
H    0.6523170958   2.9320736986   2.7121460868
H   -3.7451563553  -2.4398634435  -2.1657795315
H   -2.0274210201   0.7147268546   0.1879366711
H   -5.5340649563  -2.7057312869  -0.4950622140
H   -3.7915872317   0.4303629278   1.8569947190
*
