! 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   4.3591309896   4.9266630076   0.8956211241
O   -1.2058091968  -1.5738929942   1.4417544673
N   -1.5941939168  -3.3348487904  -0.7432597382
N   -2.2335443813  -3.8198846962  -1.8122370948
N   -2.5078685150  -5.1888571465  -0.0593830616
C   -1.2735758642  -0.9881019233   0.1611269405
C   -2.6530612298  -0.3240111952  -0.1615560800
C   -0.3002541752   0.2072917640   0.0194044625
C   -2.3079535519   0.6482748535  -1.3086654385
C   -0.8041154076   0.9693927005  -1.2045628855
C   -0.8451001142  -2.0916119540  -0.8139186798
C    1.1940170304  -0.1186096198   0.0005959608
C   -3.1502697618   0.4672879925   1.0561886949
C   -3.7737460381  -1.2768452628  -0.5635497759
C    2.0197499173   1.1187191368   0.2141813017
C   -1.7613824005  -4.1653025730   0.2858747609
C    2.5400879595   1.8391845807  -0.8568189908
C    2.2434354309   1.6026085498   1.5015148309
C    3.2592383681   3.0097961640  -0.6585594081
C    2.9606719084   2.7681296447   1.7219532620
C   -2.7659579264  -4.9209682064  -1.3511662946
C    3.4619989901   3.4649169387   0.6335904408
H   -0.4697869628   0.8282062552   0.9067677444
H   -2.9253824055   1.5461464397  -1.2475561070
H   -2.5320217548   0.1911903667  -2.2749439008
H   -0.2796784506   0.6298657182  -2.1015002080
H   -0.6088127338   2.0383308440  -1.1209735861
H    0.2009155833  -2.3405706373  -0.6319038864
H   -0.9150153818  -1.7503875387  -1.8453803502
H    1.4741500141  -0.5794878320  -0.9497246503
H    1.4204604646  -0.8434162423   0.7875040960
H   -3.4307505137  -0.1850471882   1.8865551686
H   -2.4350576472   1.2022482878   1.4303810953
H   -4.0488145532   1.0218375894   0.7814797111
H   -3.9640087916  -2.0384908812   0.1955728710
H   -4.7005613605  -0.7119135765  -0.6885192371
H   -3.5816654586  -1.7778404115  -1.5103985069
H   -1.3938363201  -0.8981648164   2.1027168377
H   -1.3181360214  -4.0107653926   1.2535567532
H    2.3869160976   1.4863644428  -1.8693149449
H    1.8544934511   1.0596328737   2.3547297043
H    3.6546164446   3.5549020871  -1.5047349297
H    3.1262494506   3.1227918718   2.7300666223
H   -3.3641512068  -5.5626670880  -1.9787132798
*