data_[Bi8Pd2Pt2]
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 [P2_1/c]
_cell_length_a [6.8340]
_cell_length_b [6.8166]
_cell_length_c [6.8322]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.5613]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Bi4PdPt]
_chemical_formula_sum '[Bi8 Pd2 Pt2]'
_cell_volume [318.2624]
_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
[
  Bi  Bi0  4  0.1303  0.6290  0.1316  1.0
  Bi  Bi1  4  0.3698  0.1309  0.1287  1.0
  Pd  Pd2  2  0.5000  0.0000  0.5000  1.0
  Pt  Pt3  2  0.0000  0.0000  0.0000  1.0
]