data_[Tl2Sb4Pd16]
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 [Cm]
_cell_length_a [7.3477]
_cell_length_b [13.6784]
_cell_length_c [4.7721]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.0291]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Tl(SbPd4)2]
_chemical_formula_sum '[Tl2 Sb4 Pd16]'
_cell_volume [387.8740]
_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  0.0041  0.0000  0.7865  1
  Sb  Sb1  4  0.0345  0.3409  0.8426  1
  Pd  Pd2  4  0.2524  0.3077  0.5606  1
  Pd  Pd3  4  0.2714  0.1727  0.0702  1
  Pd  Pd4  4  0.4833  0.3724  0.2841  1
  Pd  Pd5  2  0.0738  0.5000  0.2114  1
  Pd  Pd6  2  0.3390  0.0000  0.4871  1
]