! 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  -0.9277997611  -1.5818011130  -2.4526309082
Cl  -4.3520337732   0.9528808088   0.7988379186
O    0.7724222840  -2.7885692470   0.2697927933
N    1.6844631795  -1.9556034841  -0.3039192284
N    2.0766395320   3.5852975394   0.5797806844
C    2.1373115925   0.2294994887  -1.1321197921
C    1.2266228214  -0.7864771419  -0.5079714053
C   -0.1546018858  -0.3697345105  -0.1695536078
C    2.4592035213   1.3349575970  -0.1642443989
C   -1.2198385807  -0.6809632379  -1.0077857912
C   -0.4214708547   0.3637092296   0.9815432763
C    3.3208375696   1.1236304979   0.9062062525
C    1.8678264935   2.5868184939  -0.2714804791
C   -2.5149558497  -0.2809712812  -0.7255736214
C   -1.7073068331   0.7772843634   1.2905620539
C   -2.7411639972   0.4480672140   0.4305430443
C    3.5487973395   2.1545279193   1.8010948749
C    2.9011981271   3.3634305604   1.5964436580
C    1.3005591967  -4.0983316901   0.3665447054
H    3.0523447286  -0.2667035761  -1.4580069896
H    1.6550304499   0.6429418026  -2.0216417296
H    0.3845071763   0.6114175108   1.6591472591
H    3.8045712192   0.1634260583   1.0397544217
H    1.1879928088   2.7904889710  -1.0923168472
H   -3.3276582921  -0.5330246175  -1.3922154576
H   -1.8935274072   1.3444437122   2.1913603251
H    4.2136902487   2.0280252170   2.6440876548
H    3.0590796383   4.1874150324   2.2820179250
H    0.5327576377  -4.6987976638   0.8501452213
H    2.2072319500  -4.1285342197   0.9744748925
H    1.5136019749  -4.5245825885  -0.6160514665
*
