data_[Sb4Te12Pd24]
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 [Cmc2_1]
_cell_length_a [9.4694]
_cell_length_b [14.4563]
_cell_length_c [6.1967]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Sb(TePd2)3]
_chemical_formula_sum '[Sb4 Te12 Pd24]'
_cell_volume [848.2902]
_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  0.1805  0.9914  1
  Te  Te1  8  0.1980  0.1067  0.5861  1
  Te  Te2  4  0.0000  0.3872  0.5101  1
  Pd  Pd3  8  0.1531  0.4795  0.7935  1
  Pd  Pd4  8  0.2026  0.2789  0.7537  1
  Pd  Pd5  4  0.0000  0.0081  0.3452  1
  Pd  Pd6  4  0.0000  0.2121  0.4012  1
]