! 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   0.2387267654   0.6963166482  -2.3301965713
Cl  -1.7285513930   5.0101059122   0.0551294110
O   -0.2726326713  -1.1397335303   1.8640967868
N   -0.7761332958  -3.0788360784  -0.0965238298
N    0.1193544208  -3.8316746947  -0.7436340949
N   -0.9175924120  -5.0360316613   0.8407162982
C   -0.0149154311  -0.7938611861   0.5193651672
C    1.4757000842  -1.0029650281   0.2124199615
C   -0.9385035788  -1.6704663597  -0.3609764442
C    2.3996381258  -0.0531996792   0.9681418446
C   -0.4337224945   0.6683515549   0.3463571820
C    3.8777597866  -0.3674470397   0.7585259729
C   -0.3645317684   1.3840223846  -0.8518839075
C   -0.9192913254   1.3711507528   1.4493903075
C    4.3525057300  -0.1669189710  -0.6735979046
C   -0.7600088636   2.7108725873  -0.9500569775
C   -1.3173165609   2.6950478634   1.3829199103
C   -1.3751074289  -3.8072716794   0.8460755789
C   -1.2365293123   3.3583445542   0.1735808286
C   -0.0056126427  -4.9888601785  -0.1474421545
H    1.6483222778  -0.9235790598  -0.8591173902
H    1.7333661260  -2.0361444807   0.4708624876
H   -0.7702628713  -1.5147362883  -1.4221640122
H   -1.9771545333  -1.4145511286  -0.1517606077
H    2.2097661903   0.9785710846   0.6573218578
H    2.1784820350  -0.0957773517   2.0377346732
H    4.0817105165  -1.3946959547   1.0754242174
H    4.4647346709   0.2746223264   1.4199333684
H    0.3592265266  -1.8113205498   2.1413341222
H   -0.9880816002   0.8751565118   2.4046212703
H    5.4268640355  -0.3344008234  -0.7587592518
H    3.8653365771  -0.8491498767  -1.3715577454
H    4.1506944404   0.8503864291  -1.0150472364
H   -0.6899500605   3.2284143744  -1.8964523336
H   -1.6824882051   3.1934587350   2.2696606488
H   -2.1467280270  -3.4158294363   1.4889573890
H    0.5828938895  -5.8420054521  -0.4460565206
*
