! 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   1.7134108123  -0.5412263788  -2.7540170057
Cl  -7.7923500027   1.0264765223   1.3289656685
O    3.4352704772   0.1076147136  -0.4424494006
O    2.6249812925  -0.0219862455   1.6358275447
O   -2.6754282849   1.4457740925  -1.4916651225
N    3.6895860630  -2.4881337543   0.6686427556
N    4.6358230670  -2.7661097971  -0.2319328255
N    5.4055434616  -3.1109960027   1.8481856637
C    2.3897950854  -0.4233820200   0.3188313678
C    4.1094532607   1.1245096752   0.3004122004
C    2.4096762305  -1.9537633071   0.2879250617
C    3.2602885261   1.2435048003   1.5623188300
C    1.0335707839   0.0760808959  -0.1765036038
C    5.5440021500   0.7228766204   0.5650018035
C    0.6575962606   0.0606732294  -1.5185889412
C    0.0897083653   0.5439906932   0.7333843502
C   -0.5893434405   0.4947897084  -1.9361728199
C   -1.1582456548   1.0006806571   0.3444316236
C   -1.4934868371   0.9724470747  -1.0007210252
C    4.1675550902  -2.6832261186   1.8980849631
C    5.6374578568  -3.1339251498   0.5217900698
C   -3.8352043254   1.3213574950  -0.7709311287
C   -4.1597503838   0.1633917951  -0.0766594549
C   -4.7225477717   2.3858070557  -0.8220280648
C   -5.3788468997   0.0773692469   0.5769749168
C   -5.9472498880   2.2946439917  -0.1800928818
C   -6.2648452486   1.1418506075   0.5199564089
H    4.0834211473   2.0534051493  -0.2741636812
H    2.1713254721  -2.3279206347  -0.7043765957
H    1.6499374293  -2.3339721224   0.9702830040
H    3.8469428514   1.3930805041   2.4679132685
H    2.5252917336   2.0510509112   1.4857468485
H    6.0715848393   1.5435824355   1.0521237091
H    5.6075798870  -0.1499766714   1.2169484105
H    6.0688445045   0.4967955796  -0.3630512337
H    0.3317025118   0.5644818086   1.7866589855
H   -0.8591729178   0.4684147190  -2.9834597678
H   -1.8454650604   1.3751881354   1.0911234021
H    3.5793723172  -2.5322225941   2.7888893261
H    6.5777265486  -3.4457726070   0.0945172571
H   -3.4814527656  -0.6790479917  -0.0398443455
H   -4.4650475455   3.2829529852  -1.3695080314
H   -5.6315496126  -0.8238125079   1.1181648227
H   -6.6403284694   3.1232167008  -0.2265270477
*
