data_[Mg22Cd18In8]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [16.9785]
_cell_length_b [19.5561]
_cell_length_c [3.2571]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Mg11Cd9In4]
_chemical_formula_sum '[Mg22 Cd18 In8]'
_cell_volume [1081.4559]
_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  0.2334  0.1704  0.0000  1
  Mg  Mg1  4  0.0000  0.1853  0.0000  1
  Mg  Mg2  4  0.0000  0.3557  0.0000  1
  Mg  Mg3  4  0.2199  0.0000  0.0000  1
  Mg  Mg4  2  0.0000  0.0000  0.0000  1
  Cd  Cd5  8  0.1090  0.0923  0.5000  1
  Cd  Cd6  8  0.1232  0.2629  0.5000  1
  Cd  Cd7  2  0.0000  0.5000  0.5000  1
  In  In8  8  0.1503  0.4185  0.5000  1
]