data_[Zr2In10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.8695]
_cell_length_b [3.3418]
_cell_length_c [8.2080]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6796]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [ZrIn5]
_chemical_formula_sum '[Zr2 In10]'
_cell_volume [298.1661]
_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
[
  Zr  Zr0  2  0.2786  0.0000  0.0463  1.0
  In  In1  2  0.0828  0.5000  0.7437  1.0
  In  In2  2  0.2023  0.5000  0.3153  1.0
  In  In3  2  0.2953  0.0000  0.6661  1.0
  In  In4  2  0.4782  0.5000  0.3857  1.0
  In  In5  2  0.4961  0.5000  0.0096  1.0
]