! 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   0.6142205841  -1.0817018774  -2.1697237024
Cl   5.2805408963  -0.8651416397   0.4407039098
O   -1.0200796160   1.2418905892   1.1999840220
N   -2.8254410173  -0.8530802771   0.4800732438
N   -4.8769026587  -0.1277776629   0.8420397888
C   -0.6447285278   0.2384958449   0.2957954768
C   -1.4085832041  -1.0286010171   0.6792132571
C    0.8446502569  -0.0190938307   0.3183840922
C    1.5006566493  -0.6270187704  -0.7482230010
C    1.6098853279   0.3140499435   1.4308584282
C   -3.4756469690  -0.9105922111  -0.7231011588
C   -3.7035755249  -0.3518362784   1.3749590186
C   -1.0299793269   2.5517149048   0.6506451156
C    2.8597091827  -0.8938570788  -0.7284967426
C    2.9707551568   0.0616434284   1.4829847672
C    3.5833764734  -0.5417671919   0.3980470389
C   -4.7410584852  -0.4704179727  -0.4760790391
C   -2.1650646202   2.7402669824  -0.3053983213
C   -2.0137839652   3.1556411580  -1.5563126862
H   -0.9418646294   0.5160840642  -0.7242160691
H   -1.0707224090  -1.8767731176   0.0856117619
H   -1.2235748296  -1.2761648686   1.7250128853
H    1.1359612400   0.7880942104   2.2792929265
H   -2.9970748948  -1.2671847340  -1.6208093580
H   -3.4421199773  -0.1949435079   2.4098152709
H   -1.1400222946   3.2257348077   1.5023493667
H   -0.0742280164   2.7916787730   0.1695055998
H    3.3404813993  -1.3653123334  -1.5742432648
H    3.5404723062   0.3341973711   2.3602421601
H   -5.5598778614  -0.3915051447  -1.1736691040
H   -3.1569125200   2.5236720606   0.0801426004
H   -2.8622890517   3.3022622380  -2.2117130149
H   -1.0365824846   3.3744524360  -1.9708107547
*
