data_[Ca2Nd10Cd6]
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
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P6_3/mcm]
_cell_length_a [9.5257]
_cell_length_b [9.5257]
_cell_length_c [7.0746]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [193]
_chemical_formula_structural [CaNd5Cd3]
_chemical_formula_sum '[Ca2 Nd10 Cd6]'
_cell_volume [555.9410]
_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
  Nd  Nd1  6  0.0000  0.3337  0.7500  1
  Nd  Nd2  4  0.3333  0.6667  0.5000  1
  Cd  Cd3  6  0.0000  0.3326  0.2500  1
]