data_[Sc1Si4Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Si  1.9000  1.1000  0.5400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [7.0268]
_cell_length_b [7.0268]
_cell_length_c [3.7108]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Sc(Si2Rh3)2]
_chemical_formula_sum '[Sc1 Si4 Rh6]'
_cell_volume [158.6771]
_cell_formula_units_Z [1]
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
[
  Sc  Sc0  1  0.0000  0.0000  0.0000  1
  Si  Si1  3  0.1971  0.3942  0.5000  1
  Si  Si2  1  0.6667  0.3333  0.0000  1
  Rh  Rh3  3  0.0670  0.5335  0.0000  1
  Rh  Rh4  3  0.3907  0.1954  0.5000  1
]