data_[Nd6Dy12Y4Zr2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Dy  1.2200  1.7500  1.1310
  Y  1.2200  1.8000  1.0400
  Zr  1.3300  1.5500  0.8600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1606]
_cell_length_b [10.6413]
_cell_length_c [11.7494]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0264]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd3Dy6Y2Zr]
_chemical_formula_sum '[Nd6 Dy12 Y4 Zr2]'
_cell_volume [758.4868]
_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
[
  Nd  Nd0  4  0.0000  0.1661  0.5000  1.0
  Nd  Nd1  2  0.0000  0.5000  0.5000  1.0
  Dy  Dy2  8  0.2432  0.1630  0.2419  1.0
  Y  Y3  4  0.0000  0.3333  0.0000  1.0
  Dy  Dy4  4  0.2455  0.0000  0.7583  1.0
  Zr  Zr5  2  0.0000  0.0000  0.0000  1.0
]