! 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   1.2451115572  -0.8005442554   2.4097346329
Cl   4.2102203913  -3.4606354455  -1.1231963362
O   -1.1013626575   0.5382628201  -1.2135235122
O   -1.2356983661  -0.1010982256   0.9211297306
N   -0.8256559057   2.7018606655   0.5688954454
N   -1.1808952703   3.5537535006  -0.3968071584
N   -2.5217234034   3.7862129242   1.3878947632
C   -0.3488088593   0.3682987462  -0.0463011700
C   -2.3434539492  -0.1609454706  -1.0963499864
C   -2.1793554476  -0.9000288695   0.2288905376
C    0.2145520838   1.7263547008   0.3806602646
C    0.7978488771  -0.6150458962  -0.2864732533
C   -3.5033689251   0.8192584057  -1.1262480365
C   -4.8449209398   0.1104798921  -1.2334426465
C    1.5537533819  -1.1700663385   0.7456268359
C    1.1450725419  -0.9680785505  -1.5869230086
C    2.6007025251  -2.0452223252   0.4985083572
C    2.1848654350  -1.8395632770  -1.8637268165
C   -1.6400382839   2.8434631160   1.6156680758
C    2.9053722285  -2.3730522385  -0.8106175991
C   -2.1943370907   4.1784195477   0.1415821789
H   -2.4292989106  -0.8639675000  -1.9302122660
H   -3.0917174697  -0.9508160689   0.8223470333
H   -1.8046170742  -1.9187270083   0.0842414180
H    0.8954617918   2.0976530815  -0.3825877293
H    0.7821537031   1.6334791834   1.3045363081
H   -3.3772070678   1.4891690792  -1.9796092070
H   -3.4819610296   1.4439801608  -0.2284458054
H   -4.9085709775  -0.4871979126  -2.1443803947
H   -5.0267469942  -0.5563677871  -0.3886071250
H   -5.6618841475   0.8311936734  -1.2559672119
H    0.5895983263  -0.5548240457  -2.4160935954
H    3.1677034030  -2.4618469473   1.3189984877
H    2.4227106022  -2.0932075407  -2.8869875462
H   -1.5451054577   2.2651273276   2.5204620381
H   -2.7160901042   4.9624967003  -0.3842866590
*