data_[Nd8Ga8Pd4]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.6901]
_cell_length_b [4.5205]
_cell_length_c [10.9979]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.9694]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd2Ga2Pd]
_chemical_formula_sum '[Nd8 Ga8 Pd4]'
_cell_volume [469.3878]
_cell_formula_units_Z [4]
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  0.0134  0.0000  0.3297  1.0
  Nd  Nd1  4  0.1920  0.0000  0.1163  1.0
  Ga  Ga2  4  0.0188  0.5000  0.8896  1.0
  Ga  Ga3  4  0.1419  0.5000  0.5581  1.0
  Pd  Pd4  4  0.2274  0.5000  0.3459  1.0
]