data_[Nd6Cd48Ga3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [10.1315]
_cell_length_b [10.1315]
_cell_length_c [14.8198]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Nd2Cd16Ga]
_chemical_formula_sum '[Nd6 Cd48 Ga3]'
_cell_volume [1317.4041]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.3328  1
  Nd  Nd1  3  0.0000  0.0000  0.6789  1
  Cd  Cd2  18  0.0260  0.3583  0.6679  1
  Cd  Cd3  9  0.1786  0.3572  0.4856  1
  Cd  Cd4  9  0.1872  0.8128  0.8395  1
  Cd  Cd5  9  0.1953  0.3907  0.1787  1
  Cd  Cd6  3  0.0000  0.0000  0.0779  1
  Ga  Ga7  3  0.0000  0.0000  0.8917  1
]