data_[Bi4Sb4Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pbcm]
_cell_length_a [8.6724]
_cell_length_b [7.4542]
_cell_length_c [5.5728]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [57]
_chemical_formula_structural [BiSbPt2]
_chemical_formula_sum '[Bi4 Sb4 Pt8]'
_cell_volume [360.2594]
_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  4  0.1217  0.0882  0.7500  1.0
  Sb  Sb1  4  0.3750  0.5749  0.7500  1.0
  Pt  Pt2  4  0.1467  0.7500  0.0000  1.0
  Pt  Pt3  4  0.3929  0.2500  0.0000  1.0
]