data_[K4Yb4Cd4Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Yb  1.1000  1.7500  1.0840
  Cd  1.6900  1.5500  1.0900
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.2633]
_cell_length_b [14.9899]
_cell_length_c [11.1989]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [KYbCdSe3]
_chemical_formula_sum '[K4 Yb4 Cd4 Se12]'
_cell_volume [715.6806]
_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
[
  K  K0  4  0.0000  0.2543  0.2500  1
  Yb  Yb1  4  0.0000  0.0000  0.0000  1
  Cd  Cd2  4  0.0000  0.4620  0.7500  1
  Se  Se3  8  0.0000  0.3689  0.5517  1
  Se  Se4  4  0.0000  0.0714  0.7500  1
]