data_[Nd16Ga4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ga  1.8100  1.3000  0.7600
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.6321]
_cell_length_b [4.9849]
_cell_length_c [8.1444]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.4976]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8Ga2Pb]
_chemical_formula_sum '[Nd16 Ga4 Pb2]'
_cell_volume [666.0514]
_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  0.0511  0.0000  0.7369  1.0
  Nd  Nd1  4  0.1014  0.5000  0.4556  1.0
  Nd  Nd2  4  0.1677  0.0000  0.2532  1.0
  Nd  Nd3  4  0.1762  0.5000  0.9432  1.0
  Ga  Ga4  4  0.2143  0.0000  0.6676  1.0
  Pb  Pb5  2  0.0000  0.5000  0.0000  1.0
]