! 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  -1.5689266773  -0.3209033799  -2.5082362621
Cl  -4.7339498745   3.2456256514  -0.1092898008
F    4.0803031420   1.3785138834  -0.4055903695
F    3.8737810991   0.7751855200   1.6562978159
F    4.8079451814  -1.1880526543  -1.0936283741
F    4.5921722598  -1.7953580098   0.9944257696
O    2.5774648761  -0.1898191250   0.1135195147
N   -1.0003373264  -2.1458069817   0.9950998425
N   -0.8566264856  -3.2136800914   0.2070412255
N   -2.9920821093  -3.0066347355   0.8643886489
C    0.2025240997  -0.2164895392   0.0672763574
C    0.0896687651  -1.2245192704   1.2155092878
C    1.4314306875   0.6691345751   0.2182036570
C   -1.0326704667   0.6466720700  -0.0176409493
C   -1.8882433784   0.6600397498  -1.1164257217
C   -1.3720386479   1.4717394631   1.0543392414
C    3.7829942820   0.3150978125   0.3830807770
C   -3.0263841764   1.4531671643  -1.1565856079
C   -2.4980037449   2.2746337291   1.0458661460
C   -2.2759999029  -2.0277963111   1.3628393990
C   -3.3189486735   2.2552566047  -0.0690642012
C    4.8614890194  -0.7479358531   0.1834248445
C   -2.0708707701  -3.6957512588   0.1670069528
H    0.3181024232  -0.7802068240  -0.8599146975
H    1.0021489911  -1.8093161585   1.3096781745
H   -0.0748355275  -0.7250189971   2.1701128161
H    1.4474301007   1.4125165255  -0.5803686558
H    1.4283993122   1.1902973724   1.1783196377
H   -0.7435874743   1.4916264358   1.9360460546
H   -3.6710532569   1.4410895354  -2.0239697628
H   -2.7275217918   2.8994479967   1.8971909840
H   -2.6338219218  -1.2374114282   2.0036508055
H    5.8597223093  -0.3641167667   0.3977823252
H   -2.3022279103  -4.5915773851  -0.3870550662
*
