data_[Li4Ho4Sc2In10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.1099]
_cell_length_b [10.1099]
_cell_length_c [4.4097]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2Ho2ScIn5]
_chemical_formula_sum '[Li4 Ho4 Sc2 In10]'
_cell_volume [450.7121]
_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
[
  Li  Li0  4  0.1186  0.3814  0.0000  1.0
  Ho  Ho1  4  0.1767  0.6767  0.0000  1.0
  Sc  Sc2  2  0.0000  0.0000  0.0000  1.0
  In  In3  8  0.0710  0.2056  0.5000  1.0
  In  In4  2  0.0000  0.5000  0.5000  1.0
]