data_[Ag4Ru2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Ru  2.2000  1.3000  0.6610
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1453]
_cell_length_b [6.7320]
_cell_length_c [12.8347]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.2902]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ag2RuBr6]
_chemical_formula_sum '[Ag4 Ru2 Br12]'
_cell_volume [521.9055]
_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  4  0.1983  0.5055  0.2050  1.0
  Ru  Ru1  2  0.5000  0.0000  0.5000  1.0
  Br  Br2  4  0.1835  0.6257  0.7956  1.0
  Br  Br3  4  0.2229  0.1901  0.5250  1.0
  Br  Br4  4  0.4533  0.7091  0.6057  1.0
]