data_[Ba4Dy4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Dy  1.2200  1.7500  1.1310
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.5576]
_cell_length_b [19.3809]
_cell_length_c [6.8811]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1332]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [BaDyCl5]
_chemical_formula_sum '[Ba4 Dy4 Cl20]'
_cell_volume [740.0601]
_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
[
  Ba  Ba0  4  0.0000  0.3283  0.2500  1
  Dy  Dy1  4  0.0000  0.0761  0.2500  1
  Cl  Cl2  8  0.0076  0.8134  0.5004  1
  Cl  Cl3  8  0.2410  0.0313  0.5948  1
  Cl  Cl4  4  0.0000  0.3741  0.7500  1
]