data_[Pr24Ho8Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.3492]
_cell_length_b [11.9730]
_cell_length_c [6.2790]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.7472]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Pr6Ho2Sc]
_chemical_formula_sum '[Pr24 Ho8 Sc4]'
_cell_volume [1220.5930]
_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
[
  Pr  Pr0  8  0.0499  0.3592  0.5124  1.0
  Pr  Pr1  8  0.1101  0.1350  0.8247  1.0
  Pr  Pr2  8  0.2108  0.1395  0.3526  1.0
  Ho  Ho3  8  0.1704  0.3956  0.0753  1.0
  Sc  Sc4  4  0.0000  0.1090  0.2500  1.0
]