data_[Bi8Pd2Pt4]
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 [13.4457]
_cell_length_b [4.2746]
_cell_length_c [7.3140]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.5268]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Bi4PdPt2]
_chemical_formula_sum '[Bi8 Pd2 Pt4]'
_cell_volume [358.3201]
_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  0.1230  0.0000  0.4661  1
  Bi  Bi1  4  0.1311  0.5000  0.9652  1
  Pd  Pd2  2  0.0000  0.0000  0.0000  1
  Pt  Pt3  4  0.2466  0.5000  0.7355  1
]