data_[K4Cd4In4As8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.4288]
_cell_length_b [4.4787]
_cell_length_c [9.9310]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.6091]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KCdInAs2]
_chemical_formula_sum '[K4 Cd4 In4 As8]'
_cell_volume [632.7598]
_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  0.1634  0.5000  0.6732  1.0
  Cd  Cd1  4  0.1746  0.5000  0.0783  1.0
  In  In2  4  0.0475  0.0000  0.2018  1.0
  As  As3  4  0.1228  0.5000  0.3313  1.0
  As  As4  4  0.1294  0.0000  0.9298  1.0
]