! 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   1.7249236424   2.3108522033   0.8623579661
Cl   5.3730990616  -1.3852478873  -0.3274568850
O   -1.2648438505  -0.8807527044  -0.2608759970
O   -0.7662852682   0.7734316902   1.1809281249
N   -2.0847979170   1.7456032439  -1.0890343107
N   -3.1476040063   1.1214425985  -1.6051270428
N   -3.7949499440   2.8623779215  -0.3439815353
C   -0.4454356226   0.2296179420  -0.0739908567
C   -1.8213592896  -1.2701868195   0.9921243694
C   -1.8558013257   0.0521494148   1.7340450792
C   -3.1796638611  -1.8997214839   0.7795844130
C   -0.7490719388   1.2256934435  -1.2051371541
C    1.0303442512  -0.1522580225  -0.1076371102
C   -3.1595544228  -3.2246654644   0.0231913791
C    2.0526529880   0.7109907178   0.2846618244
C    1.4031734283  -1.4064292166  -0.5796994108
C   -2.4715558560  -4.3537459182   0.7768288401
C    3.3875330990   0.3416323079   0.2215551914
C    2.7279235749  -1.8036403031  -0.6507694818
C   -2.4883842005   2.7662983515  -0.3302093488
C    3.7117163106  -0.9197845956  -0.2461896564
C   -4.1415645168   1.8272793854  -1.1340798608
H   -1.1402848953  -1.9655668132   1.4987066531
H   -2.8010443726   0.5842282639   1.5732375684
H   -1.7027912917  -0.0602789050   2.8070691052
H   -3.8132669822  -1.1794724994   0.2539609186
H   -3.6316088463  -2.0521861438   1.7646355031
H   -0.6408702321   0.7344176316  -2.1705870784
H   -0.0548866487   2.0633126278  -1.1879090334
H   -2.6878597464  -3.0875656345  -0.9531241790
H   -4.1929408733  -3.5125061698  -0.1828159733
H    0.6412100144  -2.1012418856  -0.9025124484
H   -2.9328207051  -4.5139967583   1.7534482923
H   -2.5405735690  -5.2914817075   0.2244767134
H   -1.4110147911  -4.1578532159   0.9431305857
H    4.1594542816   1.0313159199   0.5333898612
H    2.9804697105  -2.7883690701  -1.0175206940
H   -1.8046014814   3.4195833602   0.1879525038
H   -5.1653123478   1.5923233796  -1.3796891821
*