data_[Ba16Bi24Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Bi  2.0200  1.6000  1.0350
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [9.9039]
_cell_length_b [10.0526]
_cell_length_c [17.8800]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Ba2Bi3Pt]
_chemical_formula_sum '[Ba16 Bi24 Pt8]'
_cell_volume [1780.1354]
_cell_formula_units_Z [8]
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
[
  Ba  Ba0  8  0.0000  0.2429  0.5000  1
  Ba  Ba1  8  0.2500  0.2500  0.2500  1
  Bi  Bi2  16  0.2371  0.0000  0.0907  1
  Bi  Bi3  8  0.0000  0.0000  0.2123  1
  Pt  Pt4  8  0.0000  0.0000  0.3672  1
]