! 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   5.4525431412  -2.9737412654   0.4139793856
O   -1.8450470683   1.2340576610  -1.7060245449
N   -1.0820831374   2.8338262176   0.7054859171
N   -0.5753730699   3.4390882379  -0.3741767980
N    0.6671571537   3.9033621367   1.4297807107
C   -1.8594654429   0.7482918938  -0.3834555262
C   -2.9091481528  -0.3723075564  -0.2368394149
C   -0.5434244136   0.0438699630   0.0287205446
C   -2.4325691464  -1.1665254099   0.9961111102
C   -0.9651950643  -0.7706915162   1.2511500601
C   -4.3890277103   0.0258122377  -0.1610815755
C   -2.1801063646   1.8983248040   0.5917685341
C    0.0269531980  -0.8367045353  -1.0932053308
C   -5.2513646838  -1.2256738323  -0.0063766966
C   -4.8735198299   0.8155662622  -1.3734179426
C    1.3761795804  -1.3885277889  -0.7321976550
C   -0.3252398620   3.1098302126   1.7643749333
C    2.4959514973  -0.5578326126  -0.7285647457
C    1.5502820009  -2.7213788374  -0.3729521636
C    3.7488778570  -1.0333395970  -0.3782604894
C    2.7975423378  -3.2193917661  -0.0195408397
C    0.4667240874   4.0672410035   0.1119268626
C    3.8879949588  -2.3669845453  -0.0242418202
H   -2.7998907268  -1.0052250895  -1.1266702781
H    0.2322987114   0.7708313499   0.2907453044
H   -2.5356579295  -2.2382225286   0.8289384434
H   -3.0483382489  -0.9339449873   1.8677902529
H   -0.8823487640  -0.1665970601   2.1568712409
H   -0.3208342994  -1.6359753956   1.4102424606
H   -4.5405279473   0.6398027727   0.7354296778
H   -2.3875520390   1.5339388498   1.5966639062
H   -3.0639128203   2.4419617511   0.2574951318
H    0.1201189928  -0.2457312394  -2.0057496131
H   -0.6542765347  -1.6604544599  -1.3204328429
H   -1.2725263875   2.0146653956  -1.7329185044
H   -6.3094080039  -0.9633360507   0.0464102752
H   -5.0136140084  -1.7900705982   0.8958335785
H   -5.1217401917  -1.8963059372  -0.8597174006
H   -4.3704556698   1.7734961270  -1.4915594573
H   -5.9426019056   1.0195794762  -1.2872766931
H   -4.7227778190   0.2495816513  -2.2956246399
H   -0.5336156941   2.7255279782   2.7502935317
H    2.3951521611   0.4837091541  -1.0105608866
H    0.7002504182  -3.3926795022  -0.3715802024
H    4.6045090018  -0.3721185750  -0.3853458284
H    2.9105756938  -4.2593034723   0.2548598600
H    1.1049940675   4.6706160675  -0.5138950499
*