data_[K12In8O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.5535]
_cell_length_b [10.4941]
_cell_length_c [6.2182]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.5796]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [K3In2O4]
_chemical_formula_sum '[K12 In8 O16]'
_cell_volume [753.1579]
_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  8  0.1049  0.1910  0.0473  1.0
  K  K1  4  0.0000  0.4251  0.7500  1.0
  In  In2  8  0.2411  0.3935  0.4296  1.0
  O  O3  8  0.1215  0.2428  0.5140  1.0
  O  O4  8  0.1962  0.4361  0.0969  1.0
]