! 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  -1.3962248258  -0.3520501936  -2.1947693732
Cl  -4.8462122448   3.0496333263   0.0394451763
F    3.0669365478   0.2574287113  -1.3526591826
F    4.1252485706   1.5948108582  -0.0287549178
F    4.2386864412  -1.9082705132  -0.1535064808
F    5.2945550874  -0.5812034225   1.2241562572
O    2.7014016992   0.1218217695   0.8511367553
N   -0.9003555563  -2.0966291833   0.8998016068
N   -0.6735034264  -3.0325920726  -0.0256751309
N   -2.8622281964  -2.9211761284   0.4576544622
C    0.3286444521  -0.0297884799   0.3778158125
C    0.1428143942  -1.2061100690   1.3457133291
C    1.4746898307   0.8698531762   0.8320490137
C   -0.9523058371   0.7564100938   0.2548038944
C   -1.7947657079   0.6669270124  -0.8520908258
C   -1.3776572477   1.5711273349   1.3033262189
C    3.6024461276   0.3438809124  -0.1078438990
C   -2.9888483932   1.3679123782  -0.9319027387
C   -2.5638366848   2.2819146973   1.2560245397
C   -2.2056761277  -2.0328600657   1.1636521758
C   -3.3600844051   2.1739288140   0.1286067921
C    4.7463649466  -0.6641198451  -0.0082500414
C   -1.8743511184  -3.4962407156  -0.2531384746
H    0.5928310314  -0.4363233187  -0.5992190902
H    1.0600785466  -1.7843970068   1.4359635141
H   -0.1206577721  -0.8500013358   2.3417779840
H    1.5446010143   1.7476997001   0.1882715445
H    1.3325055318   1.2232848802   1.8528566428
H   -0.7730112779   1.6547664977   2.1971616209
H   -3.6182527430   1.2786337603  -1.8062160922
H   -2.8587038719   2.9049339690   2.0884814670
H   -2.6256420666  -1.3508141338   1.8863333088
H    5.5124277108  -0.4894898940  -0.7643777356
H   -2.0455120484  -4.2948766071  -0.9576889235
*
