! 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  -4.9622945536   1.6195698144   0.6393144831
F   -2.6774930438  -2.3532033357  -1.7222816560
F   -0.6116366417  -1.7847218404  -1.8686091131
F   -1.2728074490  -3.0471150839  -0.2562582487
O    2.0178464734   1.9732215092   0.3455337666
N    2.6461058473  -0.9694561355   0.3481317038
N    0.3976246852  -0.8345189472   0.6353741912
N    4.8096945513  -1.4074993740   0.3155126701
C    1.4407507426  -0.2905834480   0.1703450116
C    1.5164525222   1.0236241199  -0.5613620344
C    1.8661394664   3.3136248446  -0.0997797535
C   -0.8433002869  -0.2112799746   0.5803673781
C    2.8312850245   3.7123841215  -1.2017424629
C   -1.8831400866  -0.7745774356  -0.1682431542
C   -1.1041496337   0.9256684083   1.3414531880
C   -3.1480314360  -0.2054349859  -0.1546829459
C    2.8057505362  -2.2044406704   0.9450698487
C    4.2922119156   3.6200275773  -0.7907113567
C    3.8976016596  -0.5447100331  -0.0066864590
C   -1.6131604068  -1.9897457334  -1.0012807414
C   -2.3659539789   1.4922759439   1.3639689915
C   -3.3805738583   0.9212085307   0.6153111613
C    4.1358953397  -2.4513899896   0.9081345698
H    0.5149026819   1.2930653298  -0.9143699641
H    2.1414375310   0.9135816847  -1.4553304298
H    2.0334910168   3.9367557117   0.7811423722
H    0.8315061057   3.4815645467  -0.4250337810
H    2.6529449713   3.1189651305  -2.1032802386
H    2.5899838087   4.7431454848  -1.4746368618
H   -0.3133586088   1.3619011138   1.9366156728
H   -3.9541411239  -0.6289830148  -0.7367910306
H    1.9767046031  -2.7763686823   1.3211028605
H    4.9496699921   3.9362638181  -1.6007752782
H    4.4996765984   4.2578536171   0.0705710703
H    4.5799612220   2.6032519930  -0.5204860445
H    4.0861395584   0.3989147083  -0.4906393510
H   -2.5482344851   2.3732937579   1.9634983570
H    4.6519719127  -3.3240392031   1.2742041830
*