data_[Na4Nd4Cd4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.1821]
_cell_length_b [4.4664]
_cell_length_c [9.2411]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5369]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaNdCdTe3]
_chemical_formula_sum '[Na4 Nd4 Cd4 Te12]'
_cell_volume [806.3377]
_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  0.1227  0.0000  0.0799  1
  Nd  Nd1  4  0.1775  0.0000  0.5977  1
  Cd  Cd2  4  0.0345  0.5000  0.7232  1
  Te  Te3  4  0.1649  0.5000  0.3528  1
  Te  Te4  4  0.1783  0.5000  0.8428  1
  Te  Te5  2  0.0000  0.0000  0.5000  1
  Te  Te6  2  0.0000  0.5000  0.0000  1
]