data_[Cs1Cd4As3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cd  1.6900  1.5500  1.0900
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.9481]
_cell_length_b [5.7096]
_cell_length_c [19.9225]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [CsCd4As3]
_chemical_formula_sum '[Cs1 Cd4 As3]'
_cell_volume [676.5944]
_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
[
  Cs  Cs0  1  0.6259  0.0000  0.6482  1
  Cd  Cd1  2  0.3254  0.2532  0.4011  1
  Cd  Cd2  1  0.0821  0.5000  0.5794  1
  Cd  Cd3  1  0.1200  0.0000  0.5296  1
  As  As4  2  0.7885  0.2839  0.4500  1
  As  As5  1  0.5864  0.5000  0.5406  1
]