data_[Li4Tl4Pd2O12]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.7274]
_cell_length_b [10.0340]
_cell_length_c [5.1972]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.4470]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Tl2PdO6]
_chemical_formula_sum '[Li4 Tl4 Pd2 O12]'
_cell_volume [290.4890]
_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  0.0000  0.1244  0.0000  1.0
  Tl  Tl1  4  0.0000  0.3361  0.5000  1.0
  Pd  Pd2  2  0.0000  0.0000  0.5000  1.0
  O  O3  8  0.1864  0.1500  0.7216  1.0
  O  O4  4  0.2382  0.0000  0.2700  1.0
]