data_[K4Rb5Cd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rb  0.8200  2.3500  1.6600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.7900]
_cell_length_b [4.7900]
_cell_length_c [32.0294]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [K4Rb5Cd]
_chemical_formula_sum '[K4 Rb5 Cd1]'
_cell_volume [734.8771]
_cell_formula_units_Z [1]
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  0.0000  0.0000  0.1736  1
  K  K1  2  0.0000  0.0000  0.3919  1
  Rb  Rb2  2  0.5000  0.5000  0.0670  1
  Rb  Rb3  2  0.5000  0.5000  0.2828  1
  Rb  Rb4  1  0.5000  0.5000  0.5000  1
  Cd  Cd5  1  0.0000  0.0000  0.0000  1
]