data_[Ho4Ag4I16]
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
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [23.0968]
_cell_length_b [6.2400]
_cell_length_c [8.5951]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.1728]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HoAgI4]
_chemical_formula_sum '[Ho4 Ag4 I16]'
_cell_volume [1195.5860]
_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
[
  Ho  Ho0  4  0.1847  0.0000  0.0804  1.0
  Ag  Ag1  4  0.1741  0.0000  0.4965  1.0
  I  I2  4  0.0806  0.0000  0.2050  1.0
  I  I3  4  0.1123  0.0000  0.7428  1.0
  I  I4  4  0.2002  0.5000  0.0701  1.0
  I  I5  4  0.2181  0.5000  0.6074  1.0
]