data_[Ho8Zr4Sc12]
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
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.4644]
_cell_length_b [9.0398]
_cell_length_c [8.4742]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.3713]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ho2ZrSc3]
_chemical_formula_sum '[Ho8 Zr4 Sc12]'
_cell_volume [630.8428]
_cell_formula_units_Z [4]
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  0.1264  0.2473  0.1234  1.0
  Zr  Zr1  4  0.0000  0.0847  0.7500  1.0
  Sc  Sc2  8  0.2436  0.0802  0.4946  1.0
  Sc  Sc3  4  0.0000  0.4127  0.7500  1.0
]