! 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  -0.3790073339  -0.7003385593  -1.7050704951
Cl   4.8981114857  -0.1989456770  -1.3307871549
O   -1.4856100410  -0.4734945874   0.9330252761
O   -0.3478707066   0.2539179444   2.6892290832
N   -1.2792570359   2.1753135262  -0.2746267717
N   -0.3357661029   2.7009489960  -1.0612997265
N   -2.2075093401   2.3030121663  -2.2348475354
C   -0.5115593639   0.4363755770   1.3066308829
C   -1.2287138200  -1.6632372587   1.6711426661
C   -0.5727584751  -1.1261649005   2.9543812760
C   -2.5166572182  -2.4224716885   1.8909553561
C   -1.0376266392   1.8587645928   1.1078844927
C    0.8230045026   0.2164598796   0.5891066972
C   -3.1624789510  -2.9188112334   0.6036360322
C    0.9669878936  -0.2561324454  -0.7138280394
C    1.9886791193   0.5665490566   1.2679429790
C   -4.4320678364  -3.7123298167   0.8703005877
C    2.2165486266  -0.3909268350  -1.3054861760
C    3.2444499990   0.4502050876   0.7006494070
C   -2.3771715013   1.9303452975  -0.9908622201
C    3.3447411408  -0.0351201700  -0.5913140578
C   -0.9382831208   2.7525530779  -2.2198929021
H   -0.5199376951  -2.2931319043   1.1185691513
H   -1.2266168016  -1.2075174917   3.8248738218
H    0.3646031177  -1.6416989555   3.1744157731
H   -3.2156440708  -1.7909010344   2.4494150340
H   -2.2888297197  -3.2761123140   2.5368045856
H   -0.3265627697   2.5800272254   1.5063702530
H   -1.9734745474   1.9680040097   1.6560800508
H   -2.4475851592  -3.5408323943   0.0572201633
H   -3.3901744965  -2.0719383773  -0.0477985547
H    1.9207649174   0.9447118021   2.2783752001
H   -4.8864123256  -4.0613918579  -0.0576088717
H   -4.2308389018  -4.5894120937   1.4882304774
H   -5.1761178733  -3.1075251095   1.3921090124
H    2.3001015372  -0.7670055397  -2.3153996333
H    4.1237553687   0.7328141358   1.2617268639
H   -3.2723302317   1.5066786127  -0.5649747323
H   -0.4443362943   3.1496746852  -3.0927752109
*