data_[Cs2Dy1Au1Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Dy  1.2200  1.7500  1.1310
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.9885]
_cell_length_b [7.9987]
_cell_length_c [8.0428]
_cell_angle_alpha [112.3971]
_cell_angle_beta [112.1228]
_cell_angle_gamma [102.9721]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2DyAuBr6]
_chemical_formula_sum '[Cs2 Dy1 Au1 Br6]'
_cell_volume [397.4741]
_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  2  0.2513  0.7498  0.5007  1.0
  Dy  Dy1  1  0.0000  0.0000  0.0000  1.0
  Au  Au2  1  0.5000  0.5000  0.0000  1.0
  Br  Br3  2  0.1488  0.7204  0.9918  1.0
  Br  Br4  2  0.2188  0.2119  0.4371  1.0
  Br  Br5  2  0.3556  0.1943  0.9995  1.0
]