! 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  -7.5305274326  -1.2508131309  -1.5142155373
F    2.5142657623  -2.9361174109   0.7344888303
F    3.2906749952  -1.8319132841  -0.9148777199
F    3.5210516255  -1.1027452893   1.1139886415
O    3.5087259417   0.8583764469  -0.6788942916
O   -2.0739758541  -2.1561430931   0.4139119888
N    3.5834210734   3.0991976473   1.1348151725
N    3.2052676653   4.3814670104   1.1129518456
N    5.4299537952   4.2172499562   0.8747511043
C    2.3167616990   1.4424860272  -0.2156900666
C    1.1911914374   0.4141641151  -0.0316205936
C    2.6220482898   2.0244061438   1.1753839000
C    1.9136369750   2.5448657806  -1.1983828232
C    1.3473468471  -0.9717010543   0.1570340147
C   -0.1142151566   0.9038985409  -0.0075295857
C    0.2265774192  -1.7909479375   0.2662343631
C   -1.2306101073   0.1017128493   0.1387145078
C   -1.0535909331  -1.2652211064   0.2487219816
C    2.6746222968  -1.6883416531   0.2634238967
C    4.9052285770   3.0198928839   0.9812788314
C    4.3430941257   5.0066690262   0.9588418609
C   -3.3314179513  -1.8799952796  -0.0600986958
C   -3.5484940216  -1.3961459298  -1.3433496946
C   -4.3990858744  -2.1740262891   0.7738937875
C   -4.8455255561  -1.1958844983  -1.7878775604
C   -5.6970905406  -1.9880164908   0.3247618118
C   -5.9106676800  -1.4939945996  -0.9519188309
H    1.7138828876   2.4166234913   1.6277080117
H    3.0022358110   1.2457093479   1.8346463985
H    1.5925508347   2.1071463988  -2.1450016680
H    1.1132743610   3.1864692582  -0.8383948360
H    2.7716617278   3.1851161952  -1.4041330899
H   -0.2882619037   1.9657260712  -0.1018628178
H    0.3270938961  -2.8603958549   0.3827850761
H    3.4501001598   0.7615438843  -1.6359034887
H   -2.2118515806   0.5562025331   0.1621047510
H    5.4434441573   2.0863726827   0.9737609800
H    4.3914680231   6.0833085931   0.9128167517
H   -2.7221357054  -1.1773525160  -2.0070512403
H   -4.2209818068  -2.5563585839   1.7702927796
H   -5.0166823727  -0.8168144727  -2.7858517639
H   -6.5293310134  -2.2227651913   0.9738811322
*