data_[Nd6Dy4Y2Bi12]
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
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.7428]
_cell_length_b [4.5482]
_cell_length_c [9.1077]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.2439]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd3Dy2YBi6]
_chemical_formula_sum '[Nd6 Dy4 Y2 Bi12]'
_cell_volume [796.0663]
_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  0.1666  0.0000  0.8331  1.0
  Nd  Nd1  2  0.0000  0.5000  0.5000  1.0
  Dy  Dy2  4  0.1667  0.0000  0.3331  1.0
  Y  Y3  2  0.0000  0.5000  0.0000  1.0
  Bi  Bi4  4  0.0020  0.0000  0.2456  1.0
  Bi  Bi5  4  0.1649  0.5000  0.0882  1.0
  Bi  Bi6  4  0.1686  0.5000  0.5782  1.0
]