data_[Bi24Pd4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.0545]
_cell_length_b [9.9636]
_cell_length_c [9.9678]
_cell_angle_alpha [90.0000]
_cell_angle_beta [134.8283]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Bi6PdPt]
_chemical_formula_sum '[Bi24 Pd4 Pt4]'
_cell_volume [989.9527]
_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
[
  Bi  Bi0  8  0.0002  0.1579  0.6598  1
  Bi  Bi1  8  0.1578  0.3403  0.1582  1
  Bi  Bi2  4  0.1589  0.5000  0.8201  1
  Bi  Bi3  4  0.1602  0.5000  0.5059  1
  Pd  Pd4  4  0.2500  0.2500  0.0000  1
  Pt  Pt5  4  0.2500  0.2500  0.5000  1
]