data_[Sn14Ru10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [8.6830]
_cell_length_b [8.6830]
_cell_length_c [6.4161]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [Sn7Ru5]
_chemical_formula_sum '[Sn14 Ru10]'
_cell_volume [483.7391]
_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
[
  Sn  Sn0  8  0.2139  0.2139  0.5161  1.0
  Sn  Sn1  4  0.0000  0.5000  0.4132  1.0
  Sn  Sn2  2  0.0000  0.0000  0.8910  1.0
  Ru  Ru3  8  0.0000  0.2397  0.1806  1.0
  Ru  Ru4  2  0.0000  0.0000  0.4811  1.0
]