! 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   1.0639589367   0.7117247003  -2.2120738866
Cl  -6.9871968441   2.2594049628  -1.0809791818
O    3.4686080895   1.2399446223  -0.5247103545
O    3.8295836538  -0.0444041428   1.2756187196
O   -2.4270131452  -0.6023778746   1.2238010259
N    3.0702677273  -2.3968901396  -0.3540470346
N    1.9577086615  -2.9317337391  -0.8658061957
N    2.6437301529  -4.1066347656   0.9183368895
C    3.1116571852   0.0239280886   0.0778496500
C    4.1906264085   2.0456905302   0.4131078103
C    3.5785045751  -1.1315974355  -0.8186783340
C    3.9815025850   1.2945280992   1.7200453796
C    1.6111956353  -0.0575139133   0.3494262996
C    5.6444003796   2.1611024574   0.0078338064
C    0.6378113369   0.2083749255  -0.6092446138
C    1.1620216868  -0.5023003799   1.5898769175
C   -0.7167249258   0.0557805794  -0.3549813661
C   -0.1813467054  -0.6480158174   1.8800982116
C   -1.1218904825  -0.3698284201   0.9015128477
C    3.4558176530  -3.0989426096   0.7134003329
C    1.7478758456  -3.9501541702  -0.0750671282
C   -3.4457074290   0.1029030266   0.6375497443
C   -3.3949117766   1.4800324454   0.4679723780
C   -4.5812378103  -0.6106771813   0.2846935462
C   -4.4872488649   2.1429714461  -0.0687424885
C   -5.6786646286   0.0535347366  -0.2391613435
C   -5.6213072477   1.4263702135  -0.4178308632
H    3.7282419826   3.0343004099   0.4456170054
H    4.6682204432  -1.1606982195  -0.8331277930
H    3.2339478518  -0.9901963645  -1.8394307905
H    4.8341737738   1.3435353721   2.3955866103
H    3.0906042924   1.6418439821   2.2537895104
H    6.1676262005   2.8311702507   0.6907159741
H    6.1474279200   1.1926233390   0.0356848621
H    5.7436944276   2.5714585661  -0.9971097776
H    1.8795193734  -0.7404090110   2.3620714533
H   -1.4353858634   0.2551329972  -1.1387219147
H   -0.4959242113  -0.9864693007   2.8581376005
H    4.3328833956  -2.8590755425   1.2925875818
H    0.9136997613  -4.6170042840  -0.2264287617
H   -2.5197133709   2.0487210027   0.7539524435
H   -4.6152986718  -1.6827302390   0.4273149545
H   -4.4491648950   3.2151238642  -0.2026017655
H   -6.5653573035  -0.5034681422  -0.5086157826
*
