data_[Li10Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.5620]
_cell_length_b [2.5461]
_cell_length_c [7.0213]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9349]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li5Ru]
_chemical_formula_sum '[Li10 Ru2]'
_cell_volume [183.2599]
_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
[
  Li  Li0  2  0.0701  0.0000  0.6448  1.0
  Li  Li1  2  0.1643  0.5000  0.2983  1.0
  Li  Li2  2  0.3154  0.0000  0.6767  1.0
  Li  Li3  2  0.3904  0.0000  0.2731  1.0
  Li  Li4  2  0.4968  0.5000  0.9787  1.0
  Ru  Ru5  2  0.2297  0.5000  0.9617  1.0
]