! 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  -1.3872393303   1.5885986451  -1.4023596222
Cl  -5.7991111804  -0.8382283097   0.6019242093
O    0.0250689900  -0.3890468763   0.2167490536
O    2.8283109141  -0.8437473532  -1.8667834038
N    2.5669366996   0.0500424586   0.2147575315
C    0.6789333994  -1.0100536992  -0.8904709098
C   -1.3279286918  -0.5011141634   0.2740672694
C    2.1376154257  -0.5749253086  -0.8960138270
C    0.5980403362  -2.5261497743  -0.8332189169
C   -3.5394425811   0.3117467632  -0.3858225065
C   -2.1446526234   0.3687957612  -0.4417832265
C   -1.9118150280  -1.4588271352   1.0871401802
C    3.8489823532   0.5148075704   0.5343848014
C   -4.0799319413  -0.6724770724   0.4422169389
C   -3.2879043113  -1.5426957811   1.1751700198
C   -4.3652579331   1.2755156515  -1.1771174445
C    3.9916247898   1.1165497812   1.7867295083
C    4.9610238351   0.4099450655  -0.3007801038
C    5.2189987376   1.6032250990   2.1997921741
C    6.1865115627   0.9039303329   0.1280671905
C    6.3289019480   1.5004461522   1.3712396113
H    0.2432946725  -0.6581616419  -1.8310314565
H    1.0473600541  -2.9162452589   0.0804253092
H    1.1199460351  -2.9559598581  -1.6865589486
H   -0.4366566272  -2.8636057537  -0.8866106101
H    1.8682974464   0.2107168919   0.9267032324
H   -1.2870945847  -2.1319667641   1.6586405458
H   -3.7417451948  -2.2882816352   1.8124799277
H   -5.4288607697   1.0864124446  -1.0714929938
H   -4.1227924710   1.2176031337  -2.2382991875
H   -4.1790243573   2.3016988353  -0.8583016206
H    3.1332196921   1.2013249017   2.4426893738
H    4.8896751356  -0.0465309003  -1.2737032545
H    5.3052050540   2.0642076328   3.1747292382
H    7.0409269831   0.8157624099  -0.5300787165
H    7.2897407830   1.8798504539   1.6913945402
*
