data_[Er14Ag4Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Ag  1.9300  1.6000  1.0867
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.8044]
_cell_length_b [10.6983]
_cell_length_c [7.0064]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Er7(AgRu)2]
_chemical_formula_sum '[Er14 Ag4 Ru4]'
_cell_volume [584.9917]
_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
[
  Er  Er0  8  0.2500  0.2500  0.2563  1
  Er  Er1  4  0.0000  0.5000  0.2454  1
  Er  Er2  2  0.0000  0.0000  0.0000  1
  Ag  Ag3  4  0.1792  0.0000  0.5000  1
  Ru  Ru4  4  0.0000  0.2934  0.0000  1
]