data_[La12Ru2Rh4Br4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2365]
_cell_length_b [12.5730]
_cell_length_c [8.1900]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1565]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6Ru(RhBr)2]
_chemical_formula_sum '[La12 Ru2 Rh4 Br4]'
_cell_volume [712.0044]
_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
[
  La  La0  8  0.2300  0.1647  0.6978  1
  La  La1  4  0.2395  0.5000  0.6970  1
  Ru  Ru2  2  0.0000  0.0000  0.5000  1
  Rh  Rh3  4  0.0000  0.3309  0.5000  1
  Br  Br4  4  0.0000  0.1655  0.0000  1
]