! 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  -1.0929807315   2.5458512849  -1.0586384371
Cl  -5.3910296658  -0.5742344816  -0.3544010716
O    2.7814033501   1.1097500406   2.2210107614
N    1.2505173618  -1.4177309694   0.1343585616
N    1.7861240864  -2.5015815090   0.7131583727
N    0.7589873014  -3.0599976401  -1.2020162194
C    3.6625619010   0.8239175549  -0.0601754004
C    2.8046412072   0.2540801467   1.1033215934
C    3.1214962590   2.1660141984  -0.5544398444
C    3.6918650392  -0.1547060533  -1.2357200899
C    5.0929476817   1.0085247227   0.4525213915
C    1.3944375885  -0.1264025673   0.6924726011
C    0.3421354416   0.6805445120   0.8105347627
C   -1.0536405081   0.3435491663   0.5038078382
C    0.6438917758  -1.7729105663  -1.0053497772
C   -1.8219921864   1.1605118346  -0.3229314676
C   -1.6765663023  -0.7750294210   1.0571371375
C    1.4631456657  -3.4532201076  -0.1205625682
C   -3.1526334677   0.8928536440  -0.5986293862
C   -3.0028137502  -1.0705089812   0.7983594068
C   -3.7300179493  -0.2284898932  -0.0282904214
H    3.2961447937  -0.6630164563   1.4424644419
H    3.7292711650   2.5234140701  -1.3872767899
H    2.0937629887   2.0924562128  -0.9143220002
H    3.1572900567   2.9528119689   0.2038133566
H    4.4398553946   0.1690119364  -1.9614043229
H    2.7418126894  -0.1989373891  -1.7690510525
H    3.9597777830  -1.1670544919  -0.9255122255
H    5.5108377533   0.0651243940   0.8113851922
H    5.1548183216   1.7324180276   1.2655390778
H    5.7376134871   1.3674241290  -0.3518214613
H    0.5213854410   1.6880155124   1.1681916861
H    2.6616539211   2.0201077170   1.9314393464
H    0.1584875285  -1.0679808261  -1.6616521870
H   -1.1181350419  -1.4203073567   1.7220411437
H    1.7444447528  -4.4784598259   0.0592658932
H   -3.7219058683   1.5438688044  -1.2469466532
H   -3.4618360615  -1.9404774104   1.2460035715
*