data_[Li2Tl1Pd1F6]
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 [P1]
_cell_length_a [5.3294]
_cell_length_b [5.6456]
_cell_length_c [5.7828]
_cell_angle_alpha [90.9368]
_cell_angle_beta [113.3937]
_cell_angle_gamma [114.7546]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li2TlPdF6]
_chemical_formula_sum '[Li2 Tl1 Pd1 F6]'
_cell_volume [141.4924]
_cell_formula_units_Z [1]
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  1  0.1070  0.0898  0.1319  1.0
  Li  Li1  1  0.1265  0.5206  0.6197  1.0
  Tl  Tl2  1  0.6517  0.3208  0.9311  1.0
  Pd  Pd3  1  0.6416  0.8208  0.4253  1.0
  F  F4  1  0.0881  0.3524  0.3166  1.0
  F  F5  1  0.1443  0.2836  0.8536  1.0
  F  F6  1  0.4428  0.0218  0.2048  1.0
  F  F7  1  0.4752  0.8597  0.6718  1.0
  F  F8  1  0.8113  0.7753  0.1842  1.0
  F  F9  1  0.8348  0.6168  0.6459  1.0
]