data_[Mg24Sn10Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Sn  1.9600  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.4771]
_cell_length_b [7.1638]
_cell_length_c [9.5686]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.9709]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg12Sn5Au2]
_chemical_formula_sum '[Mg24 Sn10 Au4]'
_cell_volume [1019.9673]
_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  8  0.1527  0.2510  0.5879  1
  Mg  Mg1  8  0.1783  0.2788  0.0962  1
  Mg  Mg2  4  0.0061  0.5000  0.1756  1
  Mg  Mg3  4  0.0719  0.0000  0.2602  1
  Sn  Sn4  4  0.1811  0.5000  0.8386  1
  Sn  Sn5  4  0.1872  0.5000  0.3629  1
  Sn  Sn6  2  0.0000  0.0000  0.5000  1
  Au  Au7  4  0.0000  0.1929  0.0000  1
]