data_[Cs4La4Cu8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.8205]
_cell_length_b [14.4637]
_cell_length_c [9.6199]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7438]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsLa(CuBr3)2]
_chemical_formula_sum '[Cs4 La4 Cu8 Br24]'
_cell_volume [1433.9411]
_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
[
  Cs  Cs0  4  0.0000  0.1391  0.2500  1.0
  La  La1  4  0.0000  0.4397  0.7500  1.0
  Cu  Cu2  8  0.2411  0.3734  0.2544  1.0
  Br  Br3  8  0.0270  0.3839  0.0715  1.0
  Br  Br4  8  0.1792  0.2759  0.7631  1.0
  Br  Br5  8  0.2133  0.0021  0.5857  1.0
]