data_[Sb4Ru2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [16.1554]
_cell_length_b [3.2095]
_cell_length_c [4.1821]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.1848]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Sb2RuCl]
_chemical_formula_sum '[Sb4 Ru2 Cl2]'
_cell_volume [210.2379]
_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  2  0.0682  0.0000  0.0712  1
  Sb  Sb1  2  0.2508  0.0000  0.7443  1
  Ru  Ru2  2  0.2023  0.5000  0.1984  1
  Cl  Cl3  2  0.4788  0.0000  0.4861  1
]