data_[Li2Tl2Pd2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [5.0269]
_cell_length_b [5.0269]
_cell_length_c [10.1204]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [LiTlPdF6]
_chemical_formula_sum '[Li2 Tl2 Pd2 F12]'
_cell_volume [255.7417]
_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  2  0.0000  0.0000  0.6671  1.0
  Tl  Tl1  2  0.0000  0.0000  0.3341  1.0
  Pd  Pd2  2  0.0000  0.0000  0.9998  1.0
  F  F3  4  0.1883  0.8117  0.8269  1.0
  F  F4  4  0.1916  0.8084  0.5065  1.0
  F  F5  4  0.2013  0.7987  0.1660  1.0
]