! 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   0.8323303378  -1.1601508958  -2.0864518300
Cl   5.6420915154  -0.5793824668   0.1267947976
O   -1.0615548636  -0.6275701236   0.0703786488
O   -0.6663202516   0.9244408225   1.6200168106
N   -2.0703097439   1.8920257472  -0.6651665025
N   -2.6329525730   2.7948527558   0.1433655600
N   -4.2058808891   1.6843139014  -1.0108858309
C   -0.3034437600   0.5088683171   0.3383248989
C   -1.4940051624  -1.2178127000   1.2942976568
C   -0.9663640652  -0.2490516534   2.3568755361
C   -3.0036731900  -1.3641312600   1.2959180718
C   -0.6584111992   1.6219369667  -0.6510187936
C    1.1939222496   0.2116228848   0.2558252614
C   -3.5631768526  -2.1983418110   0.1482340707
C    1.7711403724  -0.5278264019  -0.7756579041
C    2.0485961741   0.7205112701   1.2289430121
C   -3.0475049640  -3.6303643592   0.1194917746
C    3.1348410914  -0.7769418507  -0.8218018494
C    3.4135106507   0.4894559510   1.2073810044
C   -3.0188090606   1.2307121082  -1.3292046813
C    3.9438156362  -0.2677105765   0.1784703779
C   -3.9057363738   2.6359477197  -0.1057418437
H   -1.0184216220  -2.1964409674   1.4052829048
H   -1.7061949805  -0.0004480799   3.1175705815
H   -0.0750681624  -0.6412081527   2.8561161784
H   -3.4611757900  -0.3693798329   1.2879559659
H   -3.2860222325  -1.8252737894   2.2477097787
H   -0.3471192135   1.3472040278  -1.6574264680
H   -0.1299945174   2.5360901893  -0.3867338400
H   -3.3470177028  -1.7118716043  -0.8053462629
H   -4.6518142377  -2.2108367860   0.2374804356
H    1.6432320167   1.3163948477   2.0345445850
H   -3.2014384559  -4.1285993457   1.0783420089
H   -3.5645028438  -4.2171789459  -0.6402383388
H   -1.9823555750  -3.6794985799  -0.1086584722
H    3.5553560362  -1.3598778463  -1.6292099209
H    4.0455565845   0.8951471582   1.9845459999
H   -2.8005820520   0.4570088253  -2.0470518443
H   -4.6543064029   3.2380155568   0.3846781923
*
