data_[Ag2Pd4Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  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 [7.8968]
_cell_length_b [13.2092]
_cell_length_c [6.6301]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9787]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ag(PdBr3)2]
_chemical_formula_sum '[Ag2 Pd4 Br12]'
_cell_volume [604.9994]
_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
[
  Ag  Ag0  2  0.0000  0.5000  0.0000  1.0
  Pd  Pd1  4  0.2500  0.2500  0.5000  1.0
  Br  Br2  8  0.2271  0.1404  0.7880  1.0
  Br  Br3  4  0.0000  0.3622  0.5000  1.0
]