! 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  -1.8228377167  -3.2851427641   1.0962268216
F    1.2204786195   2.6158416993   1.1893129051
F    0.4468092646   0.6726355759   0.7260699944
F    2.0065678850   0.8974408230   2.1985136119
F   -2.6042918007   2.8130050973   0.1266395098
F   -4.4642651182   1.7640586023   0.3624245910
F   -3.0218000586   1.7544843322   1.9547050675
O    2.0571117753  -1.6807594819   0.7904582398
N    1.5137891470  -1.9170041217  -1.3985156435
N   -1.4626827739  -0.6036047806  -1.7803500145
C   -0.7152777098  -2.8985169865  -1.7622593753
C    0.7180558408  -3.1150783695  -1.2716013882
C   -1.3841267543  -1.7391347026  -1.0934783783
C    2.8075282194  -0.0209282809  -0.7369388110
C    2.0774030911  -1.2784127047  -0.3634913387
C    2.6085682389   1.1910805906  -0.0662915265
C   -1.8960929384  -1.8098278693   0.2027122117
C   -2.5299980398   0.4691567731   0.0540657808
C   -2.4782158905  -0.7035722979   0.7888415837
C    3.7670743930  -0.0870107316  -1.7404766550
C    3.3711109814   2.3007842813  -0.4055575669
C   -2.0089713002   0.4675917213  -1.2294961353
C    1.5723281446   1.3362678249   1.0111268703
C    4.5313677287   1.0225158745  -2.0702197247
C    4.3348031536   2.2165663633  -1.3998817260
C   -3.1525456591   1.7013696561   0.6255897198
H   -0.7038747718  -2.7119375126  -2.8361417647
H   -1.2734829481  -3.8222021165  -1.6016074358
H    0.7335265396  -3.4270708518  -0.2305869152
H    1.1650940004  -3.9206733851  -1.8553416864
H    1.5450340116  -1.4784376862  -2.3060167165
H   -2.8752241778  -0.7660378851   1.7931341318
H    3.9389167850  -1.0201187727  -2.2603195035
H    3.2222829599   3.2466670988   0.0956093249
H   -2.0317961006   1.3565965544  -1.8471635603
H    5.2778145011   0.9472466499  -2.8488483264
H    4.9222057604   3.0894789359  -1.6483749841
*