data_[Ac12Sb2Ru4Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Sb  2.0500  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8190]
_cell_length_b [13.5298]
_cell_length_c [8.5273]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9335]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac6SbRu2Br3]
_chemical_formula_sum '[Ac12 Sb2 Ru4 Br6]'
_cell_volume [858.2737]
_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
[
  Ac  Ac0  8  0.2485  0.3157  0.7976  1
  Ac  Ac1  4  0.1995  0.5000  0.2022  1
  Sb  Sb2  2  0.0000  0.0000  0.0000  1
  Ru  Ru3  4  0.0000  0.3329  0.0000  1
  Br  Br4  4  0.0000  0.1615  0.5000  1
  Br  Br5  2  0.0000  0.5000  0.5000  1
]