data_[La2Dy12Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1677]
_cell_length_b [3.5125]
_cell_length_c [10.5457]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.8242]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La(Dy3Sc)2]
_chemical_formula_sum '[La2 Dy12 Sc4]'
_cell_volume [545.5675]
_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
[
  La  La0  2  0.0000  0.0000  0.0000  1.0
  Dy  Dy1  4  0.0027  0.0000  0.3341  1.0
  Dy  Dy2  4  0.1696  0.5000  0.5592  1.0
  Dy  Dy3  4  0.1701  0.5000  0.8853  1.0
  Sc  Sc4  4  0.1678  0.5000  0.2251  1.0
]