! 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   4.9828145995   3.3936234442  -0.4695645386
O   -2.0972886456  -1.5262141182   1.3176343588
N   -0.6277382864  -2.8684220245  -0.8660071232
N   -0.3363964008  -3.5260657807   0.2625442967
N    1.4105745347  -3.5777871242  -1.1361316227
C   -1.9905818737  -0.9890430674   0.0178077144
C   -3.2802383042  -0.1828839516  -0.3375242173
C   -0.7962458743   0.0068308342  -0.1446579133
C   -2.7584272301   1.1238769521  -0.9523138519
C   -1.4285235117   1.3912362735  -0.2624563636
C   -4.2887917047   0.0144825063   0.8095947320
C   -1.8691676640  -2.1350705593  -1.0006491684
C    0.2771049361  -0.0883687231   0.9418556018
C   -3.8412686367   0.9632090977   1.9177843921
C   -5.6290070206   0.4809200661   0.2461906189
C    1.4601162562   0.7779261769   0.6183945409
C    0.4249775835  -2.8988653599  -1.6801174013
C    1.5893064061   2.0594862658   1.1459936157
C    2.4470797805   0.3254174222  -0.2544918644
C    2.6656195840   2.8715403493   0.8168427975
C    3.5314668271   1.1189401509  -0.5953799153
C    0.8931898739  -3.9287885007   0.0533281550
C    3.6296360041   2.3914637312  -0.0542970908
H   -3.8278079209  -0.7429779860  -1.1039194536
H   -0.3130559244  -0.2037156804  -1.1071792556
H   -3.4632152705   1.9513805091  -0.8536777883
H   -2.5913180695   0.9903843330  -2.0241719828
H   -0.7998668722   2.0885251909  -0.8178426075
H   -1.5840240630   1.8263342034   0.7280289959
H   -4.4639091879  -0.9663485396   1.2595451376
H   -1.9021704611  -1.7464315859  -2.0176197065
H   -2.6997409120  -2.8338025686  -0.8870745305
H    0.6220406895  -1.1189274609   1.0597872496
H   -0.1465192805   0.2103072393   1.9030028778
H   -1.4393690924  -2.2293812257   1.4180535642
H   -4.5804707911   0.9762394684   2.7216909111
H   -2.8885047369   0.6748351248   2.3599223109
H   -3.7464900151   1.9910209281   1.5601747248
H   -5.5601422458   1.4662522590  -0.2205424120
H   -6.3774163033   0.5531372714   1.0377948477
H   -6.0142680755  -0.2123452529  -0.5042875021
H    0.4293848764  -2.4339010706  -2.6532066003
H    0.8405323516   2.4370774216   1.8316074900
H    2.3777175608  -0.6712254303  -0.6754206628
H    2.7484263233   3.8637068978   1.2396282441
H    4.2894883430   0.7454185130  -1.2704614367
H    1.4318481291  -4.5061683702   0.7879230709
*