data_[Nd4Mg2Pd2O12]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.5055]
_cell_length_b [5.7454]
_cell_length_c [9.5896]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.8124]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Nd2MgPdO6]
_chemical_formula_sum '[Nd4 Mg2 Pd2 O12]'
_cell_volume [249.0427]
_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  0.2343  0.0616  0.2505  1.0
  Mg  Mg1  2  0.5000  0.0000  0.0000  1.0
  Pd  Pd2  2  0.0000  0.0000  0.5000  1.0
  O  O3  4  0.1440  0.2056  0.9476  1.0
  O  O4  4  0.2467  0.7005  0.9491  1.0
  O  O5  4  0.3462  0.0310  0.7478  1.0
]