data_[K4In4F16]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.0446]
_cell_length_b [11.9837]
_cell_length_c [5.5333]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.2059]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KInF4]
_chemical_formula_sum '[K4 In4 F16]'
_cell_volume [424.8609]
_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  0.0000  0.3514  0.2500  1.0
  In  In1  4  0.0000  0.0886  0.7500  1.0
  F  F2  8  0.1623  0.2023  0.6937  1.0
  F  F3  8  0.1909  0.0362  0.2210  1.0
]