data_[Na4Cd16In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.2910]
_cell_length_b [17.8692]
_cell_length_c [8.1056]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [NaCd4In]
_chemical_formula_sum '[Na4 Cd16 In4]'
_cell_volume [621.5101]
_cell_formula_units_Z [4]
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
[
  Na  Na0  4  0.0000  0.1136  0.2500  1.0
  Cd  Cd1  8  0.0000  0.3377  0.0500  1.0
  Cd  Cd2  4  0.0000  0.0648  0.7500  1.0
  Cd  Cd3  4  0.0000  0.5000  0.0000  1.0
  In  In4  4  0.0000  0.2428  0.7500  1.0
]