data_[Ho16Rh4Se8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.8172]
_cell_length_b [13.0934]
_cell_length_c [14.0909]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Ho4RhSe2]
_chemical_formula_sum '[Ho16 Rh4 Se8]'
_cell_volume [704.2668]
_cell_formula_units_Z [4]
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
[
  Ho  Ho0  8  0.0000  0.2052  0.6290  1
  Ho  Ho1  4  0.0000  0.0484  0.2500  1
  Ho  Ho2  4  0.0000  0.5000  0.0000  1
  Rh  Rh3  4  0.0000  0.3949  0.2500  1
  Se  Se4  8  0.0000  0.1421  0.0655  1
]