! 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   1.1439744588  -0.2187212300  -2.4116606721
Cl   5.7802601736  -0.4179028702   0.1976743153
O   -0.9269247555  -0.5666353099  -0.3398904989
O   -0.6421307517   0.3622410171   1.6895072531
N   -1.9222624540   2.0432853585  -0.2865742230
N   -2.5913352098   2.5836035852   0.7363264441
N   -4.0095516518   1.9543077031  -0.8857831528
C   -0.2067072780   0.4021968181   0.3567843044
C   -1.5608535326  -1.4434800013   0.5858761773
C   -1.7157398397  -0.5555330488   1.8083545113
C   -2.8647230586  -1.9435735519   0.0034575794
C   -0.5084316151   1.7886172025  -0.2374060161
C    1.2964557212   0.1518889013   0.2991277744
C   -3.6307586802  -2.8392983238   0.9700492834
C    1.9708800860  -0.1117537348  -0.8932766802
C    2.0635191904   0.2339858957   1.4574974326
C   -4.9532632102  -3.3067671333   0.3824323797
C    3.3452348525  -0.2918653337  -0.9328564036
C    3.4370856196   0.0587300490   1.4467031075
C   -2.7806011779   1.6607491175  -1.2330532972
C    4.0671905980  -0.2033231214   0.2439183451
C   -3.8312612377   2.5108272093   0.3279787857
H   -0.8984518101  -2.2896298983   0.8095037540
H   -2.6768779595  -0.0279334649   1.8097461982
H   -1.6171653801  -1.0983730302   2.7479232856
H   -2.6617638766  -2.4954928842  -0.9182626960
H   -3.4848050572  -1.0841774261  -0.2716394203
H   -0.1119046625   1.8755208713  -1.2468694281
H   -0.0319333214   2.5590267318   0.3659423613
H   -3.8244572313  -2.3039022094   1.9043477206
H   -3.0173158425  -3.7048053519   1.2350720520
H    1.5827806196   0.4423501896   2.4019072058
H   -5.6015945193  -2.4601508345   0.1491964810
H   -4.8015230705  -3.8688956385  -0.5407991039
H   -5.4922841322  -3.9521524805   1.0765294040
H    3.8410687356  -0.4949181647  -1.8717152816
H    4.0006773012   0.1301902996   2.3661177712
H   -2.4702157487   1.1988018627  -2.1564083249
H   -4.6460168953   2.8836820250   0.9284645430
*