data_[Dy12Er12In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [13.1821]
_cell_length_b [5.1652]
_cell_length_c [12.6476]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Dy3Er3In]
_chemical_formula_sum '[Dy12 Er12 In4]'
_cell_volume [861.1538]
_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  0.0876  0.2500  0.3106  1
  Dy  Dy1  4  0.1733  0.7500  0.7350  1
  Dy  Dy2  4  0.1879  0.7500  0.1323  1
  Er  Er3  4  0.0205  0.2500  0.0672  1
  Er  Er4  4  0.0526  0.2500  0.5714  1
  Er  Er5  4  0.2237  0.7500  0.4450  1
  In  In6  4  0.0530  0.2500  0.8166  1
]