data_[Mg14Cd4In4]
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 [C2/m]
_cell_length_a [7.6775]
_cell_length_b [8.6674]
_cell_length_c [8.0382]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.0866]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg7(CdIn)2]
_chemical_formula_sum '[Mg14 Cd4 In4]'
_cell_volume [513.9494]
_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  0.2328  0.3158  0.1915  1
  Mg  Mg1  4  0.1415  0.0000  0.4048  1
  Mg  Mg2  2  0.0000  0.0000  0.0000  1
  Cd  Cd3  4  0.0000  0.3057  0.5000  1
  In  In4  4  0.1081  0.5000  0.8394  1
]