! 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  -0.5461077504  -1.3981128055  -2.6709864650
Cl  -4.4632520178   0.9988343633   0.0961063869
O    0.5803852222  -2.8777245334   0.9328465885
N    1.5660552377  -2.1550826605   0.3281603173
N    3.6167595960   2.0729126727   1.7902933356
C    2.1486207084  -0.1677330033  -0.8462705961
C    1.1448338658  -1.0712206255  -0.1878775179
C   -0.2581017476  -0.6030893457  -0.1089842737
C    2.3792607468   1.0534932214   0.0023193675
C   -1.1083913086  -0.6723037819  -1.2053778409
C   -0.7462556552  -0.0342929389   1.0629970963
C    1.5944934197   2.1941895744  -0.1107279571
C    3.3724743294   1.0547250025   0.9750254078
C   -2.4043690793  -0.1844703954  -1.1606304708
C   -2.0360814326   0.4617272405   1.1388639741
C   -2.8514095507   0.3816967967   0.0211858351
C    1.8348574557   3.2641320684   0.7365117375
C    2.8539999584   3.1546475745   1.6678149061
C    1.1311882627  -4.0206397679   1.5628785728
H    3.0816715494  -0.7131652347  -0.9894690780
H    1.7886479151   0.1283007164  -1.8338866592
H   -0.1042483014   0.0334323730   1.9309218481
H    0.8107577019   2.2513565859  -0.8562401616
H    4.0067364273   0.1823006462   1.0942428851
H   -3.0486146134  -0.2498205636  -2.0261549566
H   -2.3953564429   0.9048890031   2.0566534981
H    1.2460784046   4.1687561185   0.6763691375
H    3.0657513655   3.9755583319   2.3424397895
H    0.2954262081  -4.5429227479   2.0240824925
H    1.8492457001  -3.7496264108   2.3395392414
H    1.6130403075  -4.6884307369   0.8456997034
*
