data_[Dy4Ho20Ru12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Ho  1.2300  1.7500  1.0410
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2315]
_cell_length_b [8.9853]
_cell_length_c [9.8989]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.6373]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [DyHo5Ru3]
_chemical_formula_sum '[Dy4 Ho20 Ru12]'
_cell_volume [1004.1116]
_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
[
  Dy  Dy0  4  0.1013  0.0000  0.2998  1
  Ho  Ho1  8  0.1662  0.1992  0.6673  1
  Ho  Ho2  4  0.0000  0.3012  0.0000  1
  Ho  Ho3  4  0.0671  0.5000  0.3678  1
  Ho  Ho4  4  0.2328  0.0000  0.0335  1
  Ru  Ru5  4  0.1657  0.5000  0.6673  1
  Ru  Ru6  4  0.1669  0.5000  0.1668  1
  Ru  Ru7  2  0.0000  0.0000  0.0000  1
  Ru  Ru8  2  0.0000  0.0000  0.5000  1
]