data_[Ho4B4Ru8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  B  2.0400  0.8500  0.4100
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [5.9188]
_cell_length_b [4.2360]
_cell_length_c [9.6328]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [HoBRu2]
_chemical_formula_sum '[Ho4 B4 Ru8]'
_cell_volume [241.5156]
_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  4  0.0941  0.7500  0.1193  1.0
  B  B1  4  0.1327  0.2500  0.4060  1.0
  Ru  Ru2  4  0.0897  0.7500  0.4210  1.0
  Ru  Ru3  4  0.1497  0.7500  0.7376  1.0
]