data_[K32Li8I8O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  I  2.6600  1.4000  1.2733
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [10.1354]
_cell_length_b [11.4577]
_cell_length_c [13.4823]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [K4LiIO6]
_chemical_formula_sum '[K32 Li8 I8 O48]'
_cell_volume [1565.6698]
_cell_formula_units_Z [8]
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  8  0.0643  0.5560  0.8907  1
  K  K1  8  0.1172  0.5937  0.3090  1
  K  K2  8  0.1649  0.0222  0.0619  1
  K  K3  8  0.2064  0.1904  0.6901  1
  Li  Li4  8  0.1989  0.7479  0.4904  1
  I  I5  8  0.0456  0.2456  0.3985  1
  O  O6  8  0.0291  0.6667  0.4918  1
  O  O7  8  0.0329  0.6502  0.6955  1
  O  O8  8  0.1097  0.1463  0.2949  1
  O  O9  8  0.1134  0.6514  0.0946  1
  O  O10  8  0.1393  0.1488  0.4938  1
  O  O11  8  0.2021  0.1584  0.8954  1
]