data_[La10Ru2]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.3198]
_cell_length_b [3.8922]
_cell_length_c [8.4078]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7245]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La5Ru]
_chemical_formula_sum '[La10 Ru2]'
_cell_volume [386.1039]
_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  4  0.1190  0.0000  0.3852  1.0
  La  La1  4  0.1790  0.0000  0.8209  1.0
  La  La2  2  0.0000  0.5000  0.0000  1.0
  Ru  Ru3  2  0.0000  0.5000  0.5000  1.0
]