data_[K10Li2F12]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.4068]
_cell_length_b [11.3022]
_cell_length_c [6.3825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6473]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K5LiF6]
_chemical_formula_sum '[K10 Li2 F12]'
_cell_volume [437.8952]
_cell_formula_units_Z [2]
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  0.1625  0.5000  1
  K  K1  4  0.0000  0.3308  0.0000  1
  K  K2  2  0.0000  0.5000  0.5000  1
  Li  Li3  2  0.0000  0.0000  0.0000  1
  F  F4  8  0.2493  0.3386  0.7468  1
  F  F5  4  0.1942  0.0000  0.8087  1
]