data_[La10Sb4Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sb  2.0500  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [7.6106]
_cell_length_b [7.6106]
_cell_length_c [8.7534]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [La5Sb2Ru]
_chemical_formula_sum '[La10 Sb4 Ru2]'
_cell_volume [507.0012]
_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  0.2487  0.2487  0.4985  1
  La  La1  2  0.0000  0.0000  0.2697  1
  Sb  Sb2  4  0.0000  0.5000  0.2507  1
  Ru  Ru3  2  0.0000  0.0000  0.9585  1
]