data_[Ta12Os2Ru10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Os  2.2000  1.3000  0.6730
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5293]
_cell_length_b [4.3521]
_cell_length_c [6.9201]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.2690]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ta6OsRu5]
_chemical_formula_sum '[Ta12 Os2 Ru10]'
_cell_volume [385.3916]
_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
[
  Ta  Ta0  4  0.0204  0.5000  0.7712  1
  Ta  Ta1  4  0.1597  0.0000  0.4103  1
  Ta  Ta2  4  0.1792  0.0000  0.9289  1
  Ru  Ru3  4  0.1657  0.5000  0.6366  1
  Ru  Ru4  4  0.1665  0.5000  0.1960  1
  Os  Os5  2  0.0000  0.0000  0.0000  1
  Ru  Ru6  2  0.0000  0.0000  0.5000  1
]