! 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  -4.9049475615   1.7094861855   0.5143028284
F   -2.7441189080  -2.5990120297  -1.3216141931
F   -0.6937859691  -2.0519650128  -1.6562554995
F   -1.2567094372  -3.0840839883   0.1457556297
O    2.1914027664   1.7858375211  -0.4039446215
N    2.6439555558  -1.0522997903   0.2334444542
N    0.4303158168  -0.7931419869   0.6750978912
N    4.7843318533  -1.5708005511   0.0837994041
C    1.4354873929  -0.3902042880   0.0222013029
C    1.4657537563   0.7331559900  -0.9791093741
C    2.3664837135   2.8707038758  -1.2976524389
C   -0.8077460087  -0.1690165391   0.5750755662
C    3.1577811387   3.9638206754  -0.6149355264
C   -1.8795954066  -0.8196728029  -0.0462618516
C   -1.0275575830   1.0717553098   1.1673231374
C   -3.1383739262  -0.2375504780  -0.0692165411
C    2.8421129170  -2.1441367789   1.0558233519
C    2.4784661546   4.5346334628   0.6207174451
C    3.8603941877  -0.7574462719  -0.3218718441
C   -1.6469134549  -2.1390282351  -0.7154264116
C   -2.2822810722   1.6541805490   1.1509815578
C   -3.3308302432   0.9926871922   0.5348873834
C    4.1568539212  -2.4433829283   0.9441508357
H    0.4419629885   1.0320413612  -1.2273715903
H    1.9234420412   0.3783040234  -1.9122284365
H    1.3890055848   3.2556196031  -1.6184190746
H    2.8914175280   2.5310995673  -2.1997335400
H    4.1538646617   3.5907006109  -0.3621799821
H    3.3071081097   4.7552860232  -1.3530666941
H   -0.2081839090   1.5800973839   1.6578144756
H   -3.9690932913  -0.7308362657  -0.5535114677
H    2.0454716350  -2.5967814736   1.6180938004
H    3.0579321668   5.3598179235   1.0353211069
H    1.4844610293   4.9184394855   0.3834338772
H    2.3660762737   3.7879776704   1.4065712852
H    4.0151336830   0.0567206547  -1.0095520225
H   -2.4335500705   2.6183736908   1.6161808425
H    4.6930971909  -3.2412098497   1.4316497554
*