data_[Dy12Tm4Ru12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Tm  1.2500  1.7500  1.0950
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [9.5660]
_cell_length_b [9.6786]
_cell_length_c [6.7262]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Dy3TmRu3]
_chemical_formula_sum '[Dy12 Tm4 Ru12]'
_cell_volume [622.7471]
_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  0.0000  0.2467  0.5000  1.0
  Dy  Dy1  4  0.2459  0.0000  0.5000  1.0
  Dy  Dy2  4  0.2482  0.5000  0.0000  1.0
  Tm  Tm3  4  0.0000  0.2393  0.0000  1.0
  Ru  Ru4  8  0.2500  0.2500  0.2485  1.0
  Ru  Ru5  4  0.0000  0.0000  0.2489  1.0
]