! 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  -5.1799523316   1.4712837927  -0.1514360561
F   -2.4737075775  -2.5725521036   1.5522842609
F   -1.1329912828  -3.0165575770  -0.0636383634
F   -0.4511833968  -1.8528970011   1.6112924012
O    2.0792625258   1.8245908688   0.4390469777
N    2.5221396967  -0.7783432364  -0.6710527750
N    0.2685139527  -0.6399204753  -0.9526777431
N    3.9980328187  -1.9466163000  -1.8238613784
C    1.2823964095  -0.2499829959  -0.3052411578
C    1.2977514938   0.7313645363   0.8348385000
C    2.2861142376   2.7591131640   1.4850485541
C   -0.9998517329  -0.1225976420  -0.7041106107
C    3.2809154162   3.8028839847   1.0287869983
C   -1.9184190045  -0.8031234685   0.1023896820
C   -1.3996968250   1.0530347206  -1.3331593766
C   -3.2044556742  -0.3087665379   0.2733887418
C    3.7445979627  -0.5882181741  -0.0538320897
C    4.6550275634   3.2329193767   0.7086240359
C    2.7492665257  -1.6104088852  -1.7333902161
C   -1.4994764295  -2.0614039448   0.7972123722
C   -2.6799662277   1.5486751776  -1.1664433428
C   -3.5750138197   0.8617369904  -0.3635267225
C    4.6291126973  -1.3147995691  -0.7758827821
H    1.7039306937   0.2380221526   1.7291381469
H    0.2735760931   1.0313171380   1.0793222476
H    2.6642041269   2.2449323902   2.3792692185
H    1.3347175213   3.2301541275   1.7621174652
H    2.8796916780   4.3386872138   0.1644252506
H    3.3636663745   4.5386077817   1.8320934287
H   -0.7005548068   1.5808494710  -1.9675586341
H   -3.9182491006  -0.8247558688   0.8996733585
H    3.8841406436   0.0199257954   0.8214322546
H    5.3531711057   4.0264034765   0.4409215591
H    5.0727758736   2.7048490702   1.5682026608
H    4.6227864491   2.5323722636  -0.1261475637
H    1.9610298087  -1.9224806375  -2.3974009524
H   -2.9695286006   2.4655860721  -1.6608461931
H    5.6875916282  -1.4195458733  -0.6019241499
*