data_[Mg10Tl2In4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.3329]
_cell_length_b [10.3329]
_cell_length_c [4.2109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Mg5Tl(InAu)2]
_chemical_formula_sum '[Mg10 Tl2 In4 Au4]'
_cell_volume [449.5947]
_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  0.0778  0.7937  0.5000  1
  Mg  Mg1  2  0.0000  0.5000  0.5000  1
  Tl  Tl2  2  0.0000  0.0000  0.0000  1
  In  In3  4  0.1692  0.3308  0.0000  1
  Au  Au4  4  0.1274  0.6274  0.0000  1
]