! 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  -0.8245511258  -1.2596279134  -2.6440013765
Cl  -4.3799769021   0.9832550683   0.6841752550
O    0.6856875774  -2.9493238856   0.5952711194
N    1.6109649751  -2.1691777597  -0.0340327931
N    1.8823829197   3.2605650982   0.6942977515
C    2.0802131198  -0.0687264179  -1.0570169296
C    1.1510395272  -1.0355120540  -0.3812056126
C   -0.2298171651  -0.5770433695  -0.1043848709
C    2.4117184821   1.0684017448  -0.1288974397
C   -1.2085506228  -0.6072020548  -1.0895802313
C   -0.5688382357  -0.0595839744   1.1411592645
C    3.4425150440   0.9662938162   0.7967433122
C    1.6661986901   2.2408812682  -0.1283396420
C   -2.4901725699  -0.1324751158  -0.8646366729
C   -1.8410757019   0.4229618172   1.3964173210
C   -2.7885442768   0.3816533870   0.3860609098
C    3.6841890955   2.0239794307   1.6569118556
C    2.8757537608   3.1457253585   1.5683313313
C    1.2752313621  -4.1714786032   1.0011694532
H    2.9889309352  -0.5904231737  -1.3571569031
H    1.6099606562   0.3166056448  -1.9646744799
H    0.1754988683  -0.0267031517   1.9254195332
H    4.0521911244   0.0723198793   0.8406970799
H    0.8546074327   2.3633998519  -0.8380814936
H   -3.2364644943  -0.1660839510  -1.6460316327
H   -2.0857093597   0.8250883869   2.3691885152
H    4.4841044587   1.9834756056   2.3828392115
H    3.0387629491   3.9879077233   2.2300216607
H    1.6786421119  -4.7300612011   0.1544754216
H    0.4778569791  -4.7535082929   1.4587127555
H    2.0660096476  -4.0167102538   1.7380025978
*