data_[Pr4Ho4Re16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  Re  1.9000  1.3500  0.7125
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.7370]
_cell_length_b [7.7370]
_cell_length_c [7.7370]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [216]
_chemical_formula_structural [PrHoRe4]
_chemical_formula_sum '[Pr4 Ho4 Re16]'
_cell_volume [463.1382]
_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
[
  Pr  Pr0  4  0.2500  0.2500  0.2500  1
  Ho  Ho1  4  0.0000  0.0000  0.0000  1
  Re  Re2  16  0.1251  0.1251  0.6251  1
]