data_[Tb16Ir10Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ir  2.2000  1.3500  0.7650
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [8.6574]
_cell_length_b [8.6574]
_cell_length_c [8.6365]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Tb8Ir5Pt]
_chemical_formula_sum '[Tb16 Ir10 Pt2]'
_cell_volume [647.3072]
_cell_formula_units_Z [2]
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
[
  Tb  Tb0  8  0.0633  0.3123  0.4350  1.0
  Tb  Tb1  8  0.0653  0.1829  0.8116  1.0
  Ir  Ir2  8  0.1266  0.2484  0.1235  1.0
  Ir  Ir3  2  0.0000  0.0000  0.5000  1.0
  Pt  Pt4  2  0.0000  0.5000  0.7500  1.0
]