data_[Li4In2Cu2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Cu  1.9000  1.3500  0.8200
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.5563]
_cell_length_b [5.1500]
_cell_length_c [10.1836]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.9662]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Li2InCuF6]
_chemical_formula_sum '[Li4 In2 Cu2 F12]'
_cell_volume [252.4499]
_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
[
  Li  Li0  4  0.1864  0.5097  0.7214  1.0
  In  In1  2  0.5000  0.0000  0.0000  1.0
  Cu  Cu2  2  0.0000  0.0000  0.5000  1.0
  F  F3  4  0.1566  0.1817  0.8103  1.0
  F  F4  4  0.1955  0.6804  0.5421  1.0
  F  F5  4  0.4948  0.7007  0.8628  1.0
]