data_[Tl6Sb4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.4564]
_cell_length_b [4.1651]
_cell_length_c [9.1061]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.9384]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl3(SbPd2)2]
_chemical_formula_sum '[Tl6 Sb4 Pd8]'
_cell_volume [415.6610]
_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  4  0.1177  0.5000  0.4078  1.0
  Tl  Tl1  2  0.0000  0.0000  0.0000  1.0
  Sb  Sb2  4  0.1744  0.5000  0.8209  1.0
  Pd  Pd3  4  0.1079  0.0000  0.6246  1.0
  Pd  Pd4  4  0.1692  0.5000  0.1178  1.0
]