data_[Ca2Nd12Dy6Y4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Nd  1.1400  1.8500  1.2765
  Dy  1.2200  1.7500  1.1310
  Y  1.2200  1.8000  1.0400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.3348]
_cell_length_b [10.9716]
_cell_length_c [11.9337]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.1210]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CaNd6Dy3Y2]
_chemical_formula_sum '[Ca2 Nd12 Dy6 Y4]'
_cell_volume [816.5226]
_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
[
  Ca  Ca0  2  0.0000  0.0000  0.0000  1.0
  Nd  Nd1  8  0.2449  0.3302  0.7464  1.0
  Nd  Nd2  4  0.2457  0.5000  0.2544  1.0
  Dy  Dy3  4  0.0000  0.1664  0.5000  1.0
  Y  Y4  4  0.0000  0.3333  0.0000  1.0
  Dy  Dy5  2  0.0000  0.5000  0.5000  1.0
]