! 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  -4.6452684413   1.9564410771  -0.2711073076
F   -0.4780749514  -2.0535731128   1.4890706897
F   -2.5781548158  -2.4786672672   1.3449842261
F   -1.2612298290  -3.0441342441  -0.2522864887
O    2.4874228247   1.4471642836   0.4240633379
N    2.7132252988  -1.2350450220  -0.5904557923
N    0.5033107411  -0.8392049588  -0.9593543487
N    4.8063182451  -1.9248225031  -0.4653783542
C    1.5302082197  -0.5695910210  -0.2712471585
C    1.6194053069   0.4275561192   0.8521224034
C    2.3651540063   2.6459144333   1.1755766641
C   -0.6976686542  -0.1658947947  -0.7473315158
C    1.2347994898   3.5366086311   0.6906012773
C   -1.7348485135  -0.7503795262  -0.0124547608
C   -0.9070654294   1.0811331143  -1.3285902170
C   -2.9492710169  -0.0946200470   0.1333376387
C    2.9155944769  -2.0711231356  -1.6704725474
C    1.1783226943   4.8287260117   1.4914388107
C    3.8971869776  -1.1902542927   0.0951655247
C   -1.5176252689  -2.0813325487   0.6388402878
C   -2.1151160300   1.7393718396  -1.1843869140
C   -3.1306004277   1.1450627652  -0.4543054362
C    4.2025659713  -2.4782386253  -1.5716356498
H    1.9817137703  -0.0616934959   1.7659679004
H    0.6171717040   0.8005389348   1.0762783541
H    3.3184282062   3.1687971725   1.0676228494
H    2.2429480963   2.4192659767   2.2427036543
H    1.3837717967   3.7603831621  -0.3691126464
H    0.2750456460   3.0181741165   0.7714543791
H   -0.1138682252   1.5409706902  -1.9024615575
H   -3.7535420473  -0.5363472977   0.7044173566
H    2.1461319560  -2.2858236147  -2.3899961033
H    2.1163915102   5.3825298022   1.4212776876
H    0.3836636073   5.4815411671   1.1301880003
H    0.9887621364   4.6333378854   2.5486129351
H    4.0370980690  -0.6150423731   0.9947674294
H   -2.2546410718   2.7105247157  -1.6388326127
H    4.7343349402  -3.1389035918  -2.2368430318
*