! 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  -0.9370973028  -0.1727805281  -2.4124153968
Cl  -2.9812465836   3.3866654798   0.9990486079
F    2.3381034860   1.3004686422   1.1624188472
F    4.0546971823   0.0003347204   1.3076457718
F    2.9866048385   1.8373434114  -1.4843267315
F    4.7487588923   0.5634550144  -1.2733635638
O    2.4605583954  -0.4816848287  -0.1807543269
N   -1.7352593389  -2.8355200219   0.3774244301
N   -2.0715671489  -3.1864402653  -0.8656653401
N   -3.8730028681  -2.4619105678   0.2597311102
C    0.3403005318  -1.5633064751   0.0859711283
C   -0.3548773783  -2.7402342179   0.7828953576
C    1.7591586765  -1.4469470664   0.6174220134
C   -0.4546352949  -0.2947902081   0.2680242640
C   -1.0859213154   0.3749586894  -0.7755810579
C   -0.6368349336   0.2235661774   1.5486255265
C    3.1411970023   0.4885919042   0.4280385844
C   -1.8622067462   1.5069539304  -0.5650625599
C   -1.4038062483   1.3467144433   1.7945840707
C   -2.8118526697  -2.3923170472   1.0258372642
C   -2.0129907271   1.9807559847   0.7244110507
C    3.8795468983   1.3475649041  -0.5963481855
C   -3.3571563152  -2.9517598242  -0.8825387016
H    0.4080299143  -1.8105485572  -0.9739509416
H    0.1509819990  -3.6740036460   0.5417589623
H   -0.3382137505  -2.6298803838   1.8672548834
H    1.7659112219  -1.1842392256   1.6768941046
H    2.2774047535  -2.4012044046   0.5125089148
H   -0.1727867057  -0.2692008476   2.3940821064
H   -2.3400234534   2.0054259442  -1.3968053776
H   -1.5231545367   1.7158892519   2.8031998668
H   -2.7814719294  -2.0506327471   2.0481753002
H    4.4192236723   2.1705157849  -0.1258784728
H   -3.9537029979  -3.1474797523  -1.7595812563
*
