data_[Nd4Mg3Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Mg  1.3100  1.5000  0.8600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.6591]
_cell_length_b [3.8643]
_cell_length_c [8.4856]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.5984]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Nd4Mg3Pd2]
_chemical_formula_sum '[Nd4 Mg3 Pd2]'
_cell_volume [240.6820]
_cell_formula_units_Z [1]
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  2  0.1109  0.5000  0.3155  1
  Nd  Nd1  2  0.4346  0.5000  0.7892  1
  Mg  Mg2  2  0.1995  0.0000  0.9895  1
  Mg  Mg3  1  0.5000  0.0000  0.5000  1
  Pd  Pd4  2  0.1692  0.0000  0.6185  1
]