! 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  -5.2836993577   1.1365406445   0.7265501615
F   -0.1826235844  -0.6700481930  -1.9678486510
F   -0.8654788143  -2.5333545839  -1.1385414305
F   -2.1369341093  -1.4136665684  -2.4549908882
O    2.4061081978   1.8730756337   0.0988250215
N    2.5241087478  -0.8118814532   0.9799733584
N    0.2602928687  -0.8604762258   0.9062603544
N    3.9428884144  -2.4941532429   0.8133142301
C    1.3005674475  -0.1400388277   0.9132885283
C    1.3509056757   1.3724133895   0.8611260458
C    2.2734887105   1.6490040187  -1.2950886807
C   -1.0203940249  -0.3266838477   0.8382209793
C    3.4416531127   2.2897175145  -2.0110910587
C   -1.8236594106  -0.5582287164  -0.2850414298
C   -1.5685123977   0.3504985367   1.9246275959
C   -3.1325333135  -0.0997548086  -0.3197909865
C    3.7511447670  -0.3326686471   1.3956036785
C    3.5290685257   3.7967145375  -1.8226971560
C    2.7121773721  -2.1243394280   0.6423832251
C   -1.2551866704  -1.2943458048  -1.4591576665
C   -2.8756622061   0.8020202098   1.8982210935
C   -3.6489190551   0.5751605669   0.7726608173
C    4.5987856241  -1.3842356289   1.2945171744
H    1.4709749214   1.7495689493   1.8807110648
H    0.3824634538   1.7374430398   0.4990237098
H    1.3261913562   2.0737999795  -1.6534350432
H    2.2547870705   0.5746882873  -1.5176863666
H    4.3706007259   1.8125890208  -1.6875345478
H    3.3329374694   2.0561739248  -3.0726465280
H   -0.9671990167   0.5129736338   2.8094327411
H   -3.7553325599  -0.2642256509  -1.1875499788
H    3.9125508561   0.6715189138   1.7422518418
H    3.6966715211   4.0699581788  -0.7810587892
H    4.3529693376   4.2121718428  -2.4034027131
H    2.6134897667   4.2910033827  -2.1530014694
H    1.9109594319  -2.7365193286   0.2626136798
H   -3.2806816702   1.3262525546   2.7527447237
H    5.6478574355  -1.4056558643   1.5408408689
*