! 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  -0.3131563422  -0.4497156866   2.2222438773
Cl   3.9712906812   1.7358620068  -0.0939536078
N   -1.1236670274  -2.2027028933  -0.8310871521
N   -1.6169470690  -3.0138254213   0.1082971155
N    0.5571475373  -3.4492557076  -0.2386382253
C   -1.8396428739   0.1305279439  -0.4444756034
C   -2.7817493666   1.2125543485  -0.9817927024
C   -1.8982377441  -1.1027771547  -1.3574661447
C   -0.4001850316   0.5657483683  -0.3051870482
C   -3.1236017443   2.3224731096   0.0088726139
C    0.3710757455   0.3228758651   0.8285350766
C    0.2496761874   1.1701905192  -1.3805404218
C   -1.9771532161   3.2467463683   0.3946090296
C    1.7098034396   0.6807419700   0.9099660587
C    1.5828915346   1.5347931219  -1.3375536591
C    0.1705679459  -2.4640561683  -1.0129379016
C    2.3032170549   1.2877817934  -0.1805559969
C   -0.5767147639  -3.7390564262   0.4249754741
H   -2.2232319684  -0.1754821160   0.5310264550
H   -2.3877731089   1.6461304088  -1.9051125615
H   -3.7158323332   0.7189522913  -1.2634697596
H   -1.5212133290  -0.8694007532  -2.3533837627
H   -2.9267161069  -1.4423861258  -1.4672184887
H   -3.9222551991   2.9227859150  -0.4337139645
H   -3.5507911720   1.8749691050   0.9112163064
H   -0.3002085005   1.3645395910  -2.2925295715
H   -1.2133271013   2.7406595596   0.9844070638
H   -2.3457895162   4.0804127674   0.9938496371
H   -1.4877234764   3.6663229522  -0.4862815668
H    2.2758995909   0.4826719382   1.8092319191
H    2.0481639711   2.0028811792  -2.1935828737
H    0.7819781528  -1.9354213189  -1.7274979114
H   -0.6407808460  -4.5213856615   1.1647844815
*