data_[Sb4Pd2Br16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.2599]
_cell_length_b [7.2783]
_cell_length_c [9.5942]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3344]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sb2PdBr8]
_chemical_formula_sum '[Sb4 Pd2 Br16]'
_cell_volume [888.5532]
_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
[
  Sb  Sb0  4  0.1232  0.0000  0.3909  1.0
  Pd  Pd1  2  0.0000  0.0000  0.0000  1.0
  Br  Br2  8  0.1089  0.2382  0.1563  1.0
  Br  Br3  4  0.1102  0.0000  0.6838  1.0
  Br  Br4  4  0.1673  0.5000  0.5180  1.0
]