data_[Mg4Cd2Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8147]
_cell_length_b [4.8592]
_cell_length_c [7.6078]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.0234]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg2CdAu4]
_chemical_formula_sum '[Mg4 Cd2 Au8]'
_cell_volume [259.6049]
_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  4  0.0655  0.5000  0.7246  1
  Cd  Cd1  2  0.0000  0.0000  0.0000  1
  Au  Au2  4  0.1478  0.0000  0.4257  1
  Au  Au3  4  0.2207  0.5000  0.1485  1
]