data_[K4Pr24Os4I40]
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
  Os  2.2000  1.3000  0.6730
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [15.8289]
_cell_length_b [13.8600]
_cell_length_c [14.3349]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [KPr6OsI10]
_chemical_formula_sum '[K4 Pr24 Os4 I40]'
_cell_volume [3144.9170]
_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
[
  K  K0  4  0.0590  0.2500  0.9854  1
  Pr  Pr1  8  0.0581  0.1064  0.3807  1
  Pr  Pr2  8  0.2032  0.1078  0.6157  1
  Pr  Pr3  4  0.0151  0.7500  0.3874  1
  Pr  Pr4  4  0.2240  0.7500  0.8884  1
  Os  Os5  4  0.1288  0.2500  0.4988  1
  I  I6  8  0.0383  0.0768  0.7508  1
  I  I7  8  0.1217  0.5856  0.0030  1
  I  I8  8  0.1229  0.5829  0.5029  1
  I  I9  8  0.2125  0.0892  0.2362  1
  I  I10  4  0.0320  0.7500  0.7680  1
  I  I11  4  0.2192  0.7500  0.2749  1
]