data_[Ho12Zr2In10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Zr  1.3300  1.5500  0.8600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.3152]
_cell_length_b [7.4431]
_cell_length_c [16.0299]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ho6ZrIn5]
_chemical_formula_sum '[Ho12 Zr2 In10]'
_cell_volume [634.1677]
_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  8  0.0000  0.2516  0.1686  1
  Ho  Ho1  4  0.0000  0.2439  0.5000  1
  Zr  Zr2  2  0.0000  0.0000  0.0000  1
  In  In3  4  0.0000  0.0000  0.3328  1
  In  In4  4  0.0000  0.5000  0.3442  1
  In  In5  2  0.0000  0.5000  0.0000  1
]