! 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  -4.9686259616   1.5997772108  -0.5346522979
F   -0.8546470678  -2.6765753573   0.4528101034
F   -0.0679316309  -1.1493191594   1.7464370223
F   -2.0875391446  -1.8311246966   1.9915356827
O    2.6764456069   1.8339366924   0.2885526627
N    2.7432594429  -0.6473945541  -1.1497444189
N    0.4827925486  -0.5880817907  -1.0282729742
N    4.8614205953  -1.1036854544  -1.5693922027
C    1.5603514186   0.0724867058  -0.9606894895
C    1.7136747385   1.5539019918  -0.6897174628
C    2.3661782261   1.3787962818   1.5974862249
C   -0.7729052572  -0.0168799306  -0.8837213639
C    1.2117861274   2.1107263279   2.2605420466
C   -1.6355673733  -0.4803746793   0.1187520271
C   -1.2474703139   0.9341088573  -1.7844392720
C   -2.9213864827   0.0271979484   0.2300427048
C    2.8523491885  -2.0241032988  -1.1677286855
C    1.0557269500   1.6701977206   3.7087241261
C    3.9954210945  -0.1535641746  -1.3973361384
C   -1.1628825726  -1.5332418596   1.0746376419
C   -2.5333386464   1.4345728047  -1.6849187367
C   -3.3603809607   0.9811012894  -0.6723100489
C    4.1573915729  -2.2770296871  -1.4210020936
H    0.7348875568   1.9711418799  -0.4403707766
H    2.0341817790   2.0477972383  -1.6108063743
H    3.2782092746   1.5353742766   2.1760591430
H    2.1775189800   0.2976219891   1.6025693481
H    1.3952813042   3.1870646344   2.2173107267
H    0.2735347834   1.9286500159   1.7295236838
H   -0.6076264867   1.2741509333  -2.5882365696
H   -3.5877168810  -0.3140561466   1.0093726048
H    2.0118589011  -2.6700147307  -0.9875904561
H    1.9609453259   1.8677881038   4.2851384673
H    0.2359906123   2.2011344811   4.1917792044
H    0.8430336442   0.6028516212   3.7838575173
H    4.2135129946   0.8982328095  -1.4635992425
H   -2.8795851689   2.1715206651  -2.3962102815
H    4.6356895883  -3.2392861331  -1.5024538929
*