! 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  -0.0493884043  -0.5993310442   2.7209943809
Cl  -4.3378535005  -1.1899336553  -0.4264524323
O    3.6353721930  -1.5041112494  -0.0486500115
N    2.2894649304  -1.6994216928  -0.1283778950
N   -0.4141967133   3.4024010682  -0.1497496746
C    2.1387287954   0.7071419522   0.4842091609
C    1.6041409090  -0.6617361461   0.1442878967
C    0.1347397245  -0.8336046376   0.0299609403
C    1.3487399381   1.7746435189  -0.2178051494
C   -0.7111536071  -0.7812607759   1.1325571287
C   -0.4454010160  -1.0096416792  -1.2222627790
C    1.5623297754   2.0581312263  -1.5610872199
C    0.3448627089   2.4815104655   0.4319310058
C   -2.0863272145  -0.8906601337   1.0090930061
C   -1.8160740089  -1.1234439571  -1.3790198084
C   -2.6237648057  -1.0578095333  -0.2560860620
C    0.7794264792   3.0166427981  -2.1817870247
C   -0.1961518170   3.6575081082  -1.4348896990
C    4.3225401245  -2.6672421271  -0.4751678952
H    2.0944899941   0.8550161659   1.5658943673
H    3.1900014780   0.7783233664   0.2081684076
H    0.1891406637  -1.0450985327  -2.0974911073
H    2.3325951711   1.5355123031  -2.1155543178
H    0.1493963196   2.2955069138   1.4832046962
H   -2.7217802641  -0.8530749328   1.8826393734
H   -2.2423831679  -1.2556986918  -2.3632933950
H    0.9189537341   3.2645769388  -3.2247668020
H   -0.8266049446   4.4098992099  -1.8934692673
H    4.0902163844  -2.9182831431  -1.5118866477
H    4.0997462914  -3.5260924616   0.1608678919
H    5.3830616635  -2.4369375469  -0.3979061199
*