data_[Ho8Th4Sc10]
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
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.1399]
_cell_length_b [3.4025]
_cell_length_c [13.5857]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.0053]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho4Th2Sc5]
_chemical_formula_sum '[Ho8 Th4 Sc10]'
_cell_volume [625.6642]
_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  0.1682  0.0000  0.5316  1
  Ho  Ho1  4  0.2154  0.0000  0.1885  1
  Th  Th2  4  0.1324  0.0000  0.8907  1
  Sc  Sc3  4  0.0451  0.5000  0.6313  1
  Sc  Sc4  4  0.0848  0.5000  0.2727  1
  Sc  Sc5  2  0.0000  0.5000  0.0000  1
]