data_[Ho8Zn2I10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Zn  1.6500  1.3500  0.8800
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.0510]
_cell_length_b [4.0980]
_cell_length_c [8.8952]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3268]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho4ZnI5]
_chemical_formula_sum '[Ho8 Zn2 I10]'
_cell_volume [678.4403]
_cell_formula_units_Z [2]
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  0.0001  0.0000  0.7861  1.0
  Ho  Ho1  4  0.1470  0.5000  0.0745  1.0
  Zn  Zn2  2  0.0000  0.5000  0.0000  1.0
  I  I3  4  0.1669  0.0000  0.3401  1.0
  I  I4  4  0.1749  0.0000  0.8286  1.0
  I  I5  2  0.0000  0.5000  0.5000  1.0
]