data_[Ho10Th2Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Th  1.3000  1.8000  1.0800
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.6936]
_cell_length_b [4.3374]
_cell_length_c [8.4570]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2534]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho5ThSb4]
_chemical_formula_sum '[Ho10 Th2 Sb8]'
_cell_volume [658.2954]
_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  0.1593  0.0000  0.8191  1
  Ho  Ho1  4  0.1824  0.0000  0.3480  1
  Ho  Ho2  2  0.0000  0.5000  0.5000  1
  Th  Th3  2  0.0000  0.5000  0.0000  1
  Sb  Sb4  4  0.0131  0.0000  0.2698  1
  Sb  Sb5  4  0.1736  0.5000  0.0866  1
]