data_[Ho24As9S9N3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  As  2.1800  1.1500  0.6600
  S  2.5800  1.0000  0.8800
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.8490]
_cell_length_b [7.8490]
_cell_length_c [19.3282]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ho8As3S3N]
_chemical_formula_sum '[Ho24 As9 S9 N3]'
_cell_volume [1031.2184]
_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  0.0298  0.5149  0.7409  1.0
  Ho  Ho1  6  0.0000  0.0000  0.2516  1.0
  As  As2  9  0.0000  0.5000  0.5000  1.0
  S  S3  9  0.0000  0.5000  0.0000  1.0
  N  N4  3  0.0000  0.0000  0.0000  1.0
]