data_[Y24Ag4Ru8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ag  1.9300  1.6000  1.0867
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.4064]
_cell_length_b [9.5171]
_cell_length_c [10.3731]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Y6AgRu2]
_chemical_formula_sum '[Y24 Ag4 Ru8]'
_cell_volume [928.6166]
_cell_formula_units_Z [4]
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
[
  Y  Y0  8  0.0000  0.1974  0.2418  1
  Y  Y1  8  0.1847  0.5000  0.1713  1
  Y  Y2  8  0.2197  0.3189  0.5000  1
  Ag  Ag3  2  0.0000  0.0000  0.0000  1
  Ag  Ag4  2  0.0000  0.0000  0.5000  1
  Ru  Ru5  4  0.0000  0.3230  0.0000  1
  Ru  Ru6  4  0.0000  0.5000  0.3759  1
]