data_[Mg2Bi10Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Bi  2.0200  1.6000  1.0350
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5784]
_cell_length_b [4.5743]
_cell_length_c [7.2341]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.8364]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MgBi5Au4]
_chemical_formula_sum '[Mg2 Bi10 Au8]'
_cell_volume [542.0795]
_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
[
  Mg  Mg0  2  0.0000  0.5000  0.0000  1.0
  Bi  Bi1  4  0.1606  0.0000  0.4748  1.0
  Bi  Bi2  4  0.1639  0.0000  0.9714  1.0
  Bi  Bi3  2  0.0000  0.5000  0.5000  1.0
  Au  Au4  4  0.0018  0.0000  0.2172  1.0
  Au  Au5  4  0.1685  0.5000  0.2192  1.0
]