data_[Bi16Rh2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4460]
_cell_length_b [9.2403]
_cell_length_c [6.9237]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.7024]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Bi8RhAu2]
_chemical_formula_sum '[Bi16 Rh2 Au4]'
_cell_volume [660.6116]
_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  8  0.0718  0.2082  0.7467  1.0
  Bi  Bi1  4  0.1196  0.5000  0.3351  1.0
  Bi  Bi2  4  0.2279  0.5000  0.9273  1.0
  Rh  Rh3  2  0.0000  0.0000  0.0000  1.0
  Au  Au4  4  0.1405  0.0000  0.4160  1.0
]