! 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  -0.8163615051   1.1127124820  -1.8119094673
Cl  -5.3125985088  -0.8987918267   0.3054444245
O    0.8372288886  -2.2952395179  -0.4035793831
N    1.4556469146  -1.1723767242   0.0655495332
N    4.0923864751   2.3686691952  -0.9076387633
C    1.1713948124   1.0089298047   1.0144588723
C    0.6378512326  -0.2732687716   0.4369149334
C   -0.8336620230  -0.4386858122   0.3961019524
C    2.5897045257   1.3047905070   0.6344573874
C   -1.5993780761   0.1740089428  -0.5874629778
C   -1.4876278390  -1.2096364694   1.3511211953
C    3.6701395052   0.8109393972   1.3529823009
C    2.8677174110   2.0779394561  -0.4861504552
C   -2.9779648003   0.0453768958  -0.6294725460
C   -2.8638427090  -1.3565557783   1.3361771979
C   -3.5944321742  -0.7248270419   0.3420999302
C    4.9549386183   1.1066332818   0.9269716968
C    5.1134258382   1.8843387016  -0.2084896698
C    1.7995629264  -3.2804397533  -0.7300432886
H    0.5215098446   1.8302399387   0.7053774724
H    1.0683125118   0.9511551356   2.1027882122
H   -0.9116854528  -1.6988798246   2.1252918540
H    3.5096484129   0.2075519175   2.2376841773
H    2.0504766915   2.4878791206  -1.0710469311
H   -3.5537809848   0.5291101748  -1.4057927090
H   -3.3555176448  -1.9587892385   2.0869553377
H    5.8206067537   0.7415969530   1.4619792730
H    6.1058103181   2.1304294282  -0.5671505352
H    2.3912731032  -3.5753570842   0.1392049616
H    2.4714483227  -2.9494769061  -1.5248214963
H    1.2385686024  -4.1443867155  -1.0808860985
*
