! 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  -5.3160697176   0.8036483353   0.8713798491
F   -1.7708046713  -0.1034814820  -2.7544615668
F    0.0831524292   0.3346625107  -1.7625968793
F   -0.5790440119  -1.7015783039  -1.9590910528
O    2.1890661104   1.4572334981   0.1183794771
N    2.4774089763  -1.2417164511   0.8019842864
N    0.2086247818  -1.2558502735   0.7516274528
N    4.6305002030  -1.6772503974   1.0099014760
C    1.2602412550  -0.5651585537   0.8732821973
C    1.3439537800   0.9209054124   1.0928133074
C    2.3754361194   2.8514405877   0.2606323193
C   -1.0637948723  -0.6964253932   0.7713773538
C    3.2923297898   3.3449211944  -0.8365302050
C   -1.7206229100  -0.3402525161  -0.4127182623
C   -1.7477519385  -0.5776055586   1.9785242086
C   -3.0281420680   0.1255332828  -0.3779651484
C    2.6591190933  -2.5394229880   0.3657185336
C    2.7470461823   3.1202610488  -2.2391618968
C    3.7102743531  -0.7795803597   1.1757836611
C   -1.0009418912  -0.4544229391  -1.7214957609
C   -3.0499496446  -0.1141640218   2.0171653655
C   -3.6830896132   0.2327830275   0.8353766876
C    3.9843538006  -2.7794906546   0.4967644244
H    1.7137909212   1.1075573070   2.1121814741
H    0.3377720436   1.3518406891   1.0473388682
H    2.8072278066   3.0767909073   1.2447267500
H    1.4085384235   3.3706571066   0.2076233625
H    3.4484413087   4.4127711119  -0.6670277554
H    4.2728682097   2.8728407677  -0.7313489576
H   -1.2530886414  -0.8613882496   2.8975676925
H   -3.5401778299   0.4067988724  -1.2870965455
H    1.8481472235  -3.1429436704  -0.0008572144
H    3.4261689234   3.5289399237  -2.9880550162
H    2.6142014337   2.0616646325  -2.4607693959
H    1.7804150834   3.6099541720  -2.3713189317
H    3.8753936928   0.2051966851   1.5786929897
H   -3.5630284936  -0.0284712023   2.9650910103
H    4.5172669478  -3.6830325801   0.2489620829
*