data_[Sb4Te4Pd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.2649]
_cell_length_b [7.6532]
_cell_length_c [9.4197]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.8579]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SbTePd5]
_chemical_formula_sum '[Sb4 Te4 Pd20]'
_cell_volume [498.4952]
_cell_formula_units_Z [4]
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
[
  Sb  Sb0  4  0.0000  0.4962  0.2500  1.0
  Te  Te1  4  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  8  0.1062  0.3423  0.0355  1.0
  Pd  Pd3  8  0.2008  0.1809  0.3438  1.0
  Pd  Pd4  4  0.0000  0.1566  0.7500  1.0
]