! 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  -0.5485951162  -0.6131157051  -2.9954190413
Cl  -3.8469421257   0.0211549761   1.1981222597
O    1.3312646192   0.8451253003  -1.4206608906
O    1.4052564622  -1.4344019118   2.5246111629
O    2.8244404573   0.2819561596   2.4031438427
C    3.2984160664  -0.1742866048  -0.3946208129
C    2.5564678334   1.1055805429  -0.7352242576
C    2.5634481790  -1.1650640741   0.4962152486
C    0.1824710852   0.6806583515  -0.7461196288
C    2.2900626675  -0.6726868131   1.8876655393
C   -0.8429182401  -0.0026893452  -1.4089155609
C   -0.0796081312   1.1588328574   0.5344568028
C   -2.0801504974  -0.2041788048  -0.8256059034
C   -1.3115017695   0.9541849554   1.1362438123
C   -2.3048090218   0.2760848711   0.4544285840
H    4.2440295543   0.1158318868   0.0680732717
H    3.5592960499  -0.6872019739  -1.3218651921
H    3.1565492290   1.6888673288  -1.4324995930
H    2.4042856050   1.7334125352   0.1424857297
H    3.1783830439  -2.0647150481   0.6025470071
H    1.6356003329  -1.5144646914   0.0391356356
H    0.6646853890   1.7124742257   1.0881742434
H   -2.8520097682  -0.7365746804  -1.3639255806
H   -1.4844257328   1.3355563309   2.1327450747
H    1.2799076627  -1.1111287623   3.4297525947
*
