data_[Na4Cd4In12]
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 [P2_1/c]
_cell_length_a [9.4383]
_cell_length_b [7.7520]
_cell_length_c [8.2825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.7330]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [NaCdIn3]
_chemical_formula_sum '[Na4 Cd4 In12]'
_cell_volume [545.8999]
_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  0.0829  0.1959  0.5419  1.0
  Cd  Cd1  4  0.1741  0.5602  0.7719  1.0
  In  In2  4  0.1798  0.5598  0.4060  1.0
  In  In3  4  0.3626  0.6192  0.1776  1.0
  In  In4  4  0.4059  0.2444  0.4574  1.0
]