data_[Ho1Ag1Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9203]
_cell_length_b [7.2862]
_cell_length_c [7.8032]
_cell_angle_alpha [69.9851]
_cell_angle_beta [72.2286]
_cell_angle_gamma [85.8145]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [HoAgBr6]
_chemical_formula_sum '[Ho1 Ag1 Br6]'
_cell_volume [300.9971]
_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
[
  Ho  Ho0  1  0.5000  0.5000  0.0000  1
  Ag  Ag1  1  0.0000  0.0000  0.0000  1
  Br  Br2  2  0.0883  0.6610  0.1937  1
  Br  Br3  2  0.2373  0.1363  0.1600  1
  Br  Br4  2  0.4649  0.6856  0.6448  1
]