
SystemLabel     benzene
NumberOfSpecies 2

%block ChemicalSpeciesLabel
1 6 C
2 1 H
%endblock ChemicalSpeciesLabel

Denchar.TypeOfRun 3D
Denchar.PlotCharge F
Denchar.PlotWaveFunctions T
Denchar.CoorUnits Bohr
Denchar.NumberPointsX 45
Denchar.NumberPointsY 30
Denchar.NumberPointsZ 50
Denchar.MinX  0.000000000 Bohr
Denchar.MaxX 11.733333333 Bohr
Denchar.MinY  0.000000000 Bohr
Denchar.MaxY  7.733333333 Bohr
Denchar.MinZ  0.000000000 Bohr
Denchar.MaxZ 13.72 Bohr

