data_[Tl1Ag2Pd1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1421]
_cell_length_b [6.3098]
_cell_length_c [7.8644]
_cell_angle_alpha [88.2759]
_cell_angle_beta [88.2802]
_cell_angle_gamma [86.6333]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TlAg2PdCl8]
_chemical_formula_sum '[Tl1 Ag2 Pd1 Cl8]'
_cell_volume [304.0008]
_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
[
  Tl  Tl0  1  0.0000  0.0000  0.5000  1.0
  Ag  Ag1  2  0.4985  0.4972  0.2365  1.0
  Pd  Pd2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.2033  0.1651  0.7741  1.0
  Cl  Cl4  2  0.2115  0.1706  0.2366  1.0
  Cl  Cl5  2  0.2630  0.6997  0.0012  1.0
  Cl  Cl6  2  0.2796  0.6745  0.5006  1.0
]