! 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  -5.9877942609  -4.3830914376  -0.8700102670
F    1.8280600644  -1.3116290510   1.8027188406
F    0.5175035854  -2.4363477386   0.5557183609
F    2.2661780539  -1.5861026229  -0.3023689617
O    3.2331769012   0.6846178048   0.6910038957
O   -3.1174443578   0.6382073749   0.0633883345
N    4.1242442114   3.2632488363   0.4413172508
N    4.9010919743   3.7234340771  -0.5453695867
N    6.1164022908   3.3658901933   1.3069227598
C    2.5149731372   1.4908705338  -0.2090247236
C    1.0276183052   1.1449964689  -0.1193861106
C    2.7284018701   2.9596563150   0.2510441854
C    2.9879128095   1.3034065333  -1.6490954594
C    0.4874899725  -0.1010801259   0.2479530925
C    0.1195077441   2.1411809308  -0.4793511203
C   -0.8948183663  -0.2724748878   0.3135964213
C   -1.2499167725   1.9654134108  -0.4500606267
C   -1.7590557616   0.7517226656  -0.0304753563
C    1.2935112718  -1.3384154746   0.5797198009
C    4.8639571745   3.0478400142   1.5287819133
C    6.0774920827   3.7689030098   0.0236652280
C   -3.7327186472  -0.5666063549  -0.1652218375
C   -4.7678667679  -0.9208388084   0.6860723565
C   -3.3906205764  -1.3786905058  -1.2385653325
C   -5.4715498781  -2.0944708359   0.4652477171
C   -4.0843196446  -2.5590739429  -1.4514045925
C   -5.1197954923  -2.9090139618  -0.5986722394
H    2.3402032008   3.6816745080  -0.4620065510
H    2.2227650957   3.1249919477   1.2023431921
H    2.4501470843   1.9688710018  -2.3235786353
H    4.0520147478   1.5226241791  -1.7516746135
H    2.8203085252   0.2822753416  -1.9879095943
H    0.4775034614   3.1041029259  -0.8127124185
H   -1.3084016476  -1.2166128122   0.6361034689
H    4.0541273532   0.3967013325   0.2791946326
H   -1.9106825696   2.7707261523  -0.7419896668
H    4.4523115514   2.6862336367   2.4569000332
H    6.9476803766   4.1156767915  -0.5112564928
H   -5.0311830948  -0.2807514665   1.5176568049
H   -2.5940043800  -1.1045276354  -1.9179713876
H   -6.2802613063  -2.3683086645   1.1285328423
H   -3.8177844734  -3.1930020791  -2.2855992827
*