data_[K4Na16In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Na  0.9300  1.8000  1.1600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.9265]
_cell_length_b [8.8246]
_cell_length_c [6.6406]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9282]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KNa4In]
_chemical_formula_sum '[K4 Na16 In4]'
_cell_volume [943.7471]
_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  0.2221  0.0000  0.1463  1.0
  Na  Na1  8  0.1091  0.1996  0.5581  1.0
  Na  Na2  4  0.0000  0.2083  0.0000  1.0
  Na  Na3  4  0.1616  0.5000  0.2348  1.0
  In  In4  4  0.0383  0.5000  0.7379  1.0
]