! 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   5.3886635221   3.1426627099  -0.9657945649
O   -2.2733111000   0.0605507924   2.0486757462
N   -0.9580243205  -2.7986142227   0.2246437957
N    0.3548905764  -2.8630576802  -0.0164092901
N   -0.7689277833  -4.1494856113  -1.4705870461
C   -1.7683976290  -0.5158911491   0.8568372377
C   -2.7154525390  -0.3467578563  -0.3453301696
C   -0.5239261252   0.2466911270   0.3678465589
C   -2.5310644433   1.1300846471  -0.7400145590
C   -1.1154812962   1.5179576581  -0.2587539590
C   -4.1620388136  -0.8501999141  -0.2305137877
C   -1.5142874608  -1.9691129606   1.2670198196
C    0.5386046804   0.4983771907   1.4333306782
C   -5.0632086053  -0.0857220052   0.7360072115
C   -4.7999255331  -0.8744855829  -1.6186024348
C    1.7557431328   1.1625699674   0.8553257759
C   -1.6087342437  -3.5646349289  -0.6506677606
C    1.9865586950   2.5245035960   1.0216947078
C    2.6732523953   0.4269394732   0.1071132262
C    3.0975907960   3.1429544447   0.4647348528
C    3.7898421265   1.0244148482  -0.4562354000
C    0.4153408853  -3.6823630510  -1.0347178215
C    3.9918817587   2.3837326002  -0.2707291123
H   -2.2596699192  -0.9349792004  -1.1513964861
H   -0.0688067854  -0.3454034767  -0.4315032842
H   -3.2839425835   1.7678098019  -0.2718551052
H   -2.6474100172   1.2641333449  -1.8148722682
H   -0.4909669879   1.8892486401  -1.0706023238
H   -1.1638089198   2.3234767038   0.4796628404
H   -4.1235360409  -1.8888448469   0.1197894625
H   -2.4496748384  -2.4301767146   1.5858337124
H   -0.8366560294  -2.0104162439   2.1198737728
H    0.8335835873  -0.4513231350   1.8877131535
H    0.1273797114   1.1187091906   2.2320195581
H   -2.5781107445   0.9563413343   1.8691520139
H   -6.0778886323  -0.4858163363   0.6895382785
H   -4.7334828419  -0.1653578072   1.7695262342
H   -5.1306455293   0.9743806995   0.4837740167
H   -5.7928435732  -1.3258406789  -1.5843697914
H   -4.2013342212  -1.4501096754  -2.3276566523
H   -4.9150479065   0.1325604036  -2.0254375015
H   -2.6813337123  -3.6815275987  -0.6462730466
H    1.2922942507   3.1210607175   1.6007890405
H    2.5167826269  -0.6358323743  -0.0367701189
H    3.2600671551   4.2024535871   0.6086645213
H    4.4934927396   0.4351849494  -1.0284285916
H    1.3583452624  -3.9580381549  -1.4802216156
*