! 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  -5.1795021584  -2.9617657232  -0.8235595214
Cl   2.9586422679   3.2791423482  -1.2232215139
O    0.0457732313   2.1252121548  -2.0336012622
N    0.6285872095   0.1404051786  -1.1359142696
N    2.3349064402   3.7600420974   1.2498733980
C    0.5118375570  -1.6575239246   0.5110497317
C    1.2405770790  -0.6565704067  -0.1401474380
C   -0.8946329452  -1.9552135587   0.1652740098
C    1.1356920106  -2.3773814216   1.5281825740
C    2.5672173959  -0.4200786628   0.2013323660
C   -1.8855751567  -1.8828108149   1.1417257150
C   -1.2553738271  -2.3489943459  -1.1221721052
C    2.4492954286  -2.1208236699   1.8880538072
C    3.1693421155  -1.1420091250   1.2181727352
C    0.5120421298   1.4823844238  -1.1078206695
C    0.9310910081   2.1639426349   0.1553001796
C   -3.2050461340  -2.1889952555   0.8457362973
C   -2.5695543223  -2.6579600205  -1.4339977429
C   -3.5353413273  -2.5735568619  -0.4436454398
C    0.2167901977   1.9807500641   1.3304883680
C    1.9827367933   3.0708309359   0.1940498627
C    0.5664905177   2.7076498437   2.4565208131
C    1.6301494237   3.5867243714   2.3652546099
H    0.5809891719  -3.1542430632   2.0396106005
H    3.1342013001   0.3316217844  -0.3332733108
H    0.2203472933  -0.3158574676  -1.9412908211
H   -1.6313988085  -1.5788335665   2.1491027270
H   -0.5030640669  -2.4497552775  -1.8949492935
H    2.9113088486  -2.6925937326   2.6814516147
H    4.2007042470  -0.9450378705   1.4780198599
H   -3.9620181666  -2.1258427535   1.6152338428
H   -2.8297711400  -2.9691020751  -2.4362544665
H   -0.6101601870   1.2826510234   1.3637074008
H    0.0267911391   2.5954140081   3.3853688269
H    1.9357402812   4.1762216061   3.2198208243
*
