data_[K2Nd2Cd2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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 [P2_1/m]
_cell_length_a [9.6498]
_cell_length_b [4.6017]
_cell_length_c [10.8522]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.6034]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KNdCdTe3]
_chemical_formula_sum '[K2 Nd2 Cd2 Te6]'
_cell_volume [461.8026]
_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
[
  K  K0  2  0.2114  0.2500  0.2376  1.0
  Nd  Nd1  2  0.3244  0.7500  0.8618  1.0
  Cd  Cd2  2  0.0849  0.2500  0.6080  1.0
  Te  Te3  2  0.0938  0.2500  0.8698  1.0
  Te  Te4  2  0.2289  0.7500  0.5370  1.0
  Te  Te5  2  0.4575  0.7500  0.1621  1.0
]