data_[Ho24P9Au3Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  P  2.1900  1.0000  0.5500
  Au  2.5400  1.3500  1.0700
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.0600]
_cell_length_b [8.0600]
_cell_length_c [19.9663]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ho8P3AuSe4]
_chemical_formula_sum '[Ho24 P9 Au3 Se12]'
_cell_volume [1123.3020]
_cell_formula_units_Z [3]
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  18  0.0084  0.5042  0.7545  1.0
  Ho  Ho1  6  0.0000  0.0000  0.2421  1.0
  P  P2  9  0.0000  0.5000  0.5000  1.0
  Au  Au3  3  -0.0000  -0.0000  0.5000  1.0
  Se  Se4  9  0.0000  0.5000  0.0000  1.0
  Se  Se5  3  0.0000  0.0000  0.0000  1.0
]