! 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  -0.5681991378  -0.5565414425   2.5500945844
Cl   2.0361094571  -4.0290650209  -0.5348054636
O   -1.7432546706   1.4337939530   0.7318415291
O   -0.7300303408   1.9847104401  -1.1654931769
N    1.8024682613   2.2168191748   0.3981802482
N    2.6752371203   1.3880963646   0.9789894127
N    3.5307991469   2.2235710472  -0.9196377027
C   -0.5016639853   1.4230501996   0.0950447463
C   -2.7619622944   1.3008129385  -0.2602216234
C   -2.0000458572   1.5046609700  -1.5786773877
C   -3.4773610970  -0.0336647509  -0.1694009012
C    0.4487780870   2.3371672309   0.8753546587
C    0.0812435025   0.0165291389  -0.0435666668
C   -4.6470500724  -0.1143437239  -1.1436252140
C    0.1056378903  -0.9095350421   0.9958533344
C    0.7037610884  -0.3482451095  -1.2338064481
C   -5.3651861902  -1.4526919949  -1.0753756055
C    0.6961606156  -2.1559834213   0.8525604366
C    1.3089463927  -1.5810512941  -1.4037562375
C    2.3207772143   2.6915044283  -0.7364317961
C    1.2933178466  -2.4794474694  -0.3525200732
C    3.6895725428   1.4301388485   0.1570904674
H   -3.4788935271   2.1105793255  -0.0952126113
H   -1.9015355747   0.5667285833  -2.1377777038
H   -2.4555309820   2.2474305780  -2.2311157308
H   -3.8448932087  -0.1758032566   0.8503349748
H   -2.7711888242  -0.8463857334  -0.3687009279
H    0.4426615926   2.0803551867   1.9318882718
H    0.1187021433   3.3714003634   0.7775824088
H   -4.2971566008   0.0534741006  -2.1668682885
H   -5.3524666522   0.6931398746  -0.9277593193
H    0.7255493084   0.3473584186  -2.0609286609
H   -5.7423900904  -1.6492075032  -0.0703093478
H   -6.2151379302  -1.4830447212  -1.7576482308
H   -4.6983033102  -2.2739775362  -1.3429217136
H    0.6952721870  -2.8579077941   1.6746999007
H    1.7827393873  -1.8289405929  -2.3428972970
H    1.7994240291   3.3826068136  -1.3789927501
H    4.5906540184   0.8685916471   0.3465061003
*