data_[K3Pr3Ho12Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.5378]
_cell_length_b [8.5378]
_cell_length_c [21.4910]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [KPr(HoSe2)4]
_chemical_formula_sum '[K3 Pr3 Ho12 Se24]'
_cell_volume [1356.6866]
_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
[
  K  K0  3  0.0000  0.0000  0.6299  1
  Pr  Pr1  3  0.0000  0.0000  0.9951  1
  Ho  Ho2  9  0.0121  0.5061  0.5016  1
  Ho  Ho3  3  0.0000  0.0000  0.3739  1
  Se  Se4  9  0.0138  0.5069  0.7549  1
  Se  Se5  9  0.1836  0.3671  0.5741  1
  Se  Se6  3  0.0000  0.0000  0.2425  1
  Se  Se7  3  0.0000  0.0000  0.7671  1
]