data_[Tl2Pd2F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [Cm]
_cell_length_a [5.9470]
_cell_length_b [7.1136]
_cell_length_c [3.8498]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.9506]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [TlPdF3]
_chemical_formula_sum '[Tl2 Pd2 F6]'
_cell_volume [160.8816]
_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
[
  Tl  Tl0  2  0.0000  0.0000  0.0209  1.0
  Pd  Pd1  2  0.3577  0.0000  0.5304  1.0
  F  F2  4  0.3633  0.2841  0.5284  1.0
  F  F3  2  0.1121  0.5000  0.9781  1.0
]