data_[Nd4Sc2Pd2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sc  1.3600  1.6000  0.8850
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [10.1503]
_cell_length_b [5.5974]
_cell_length_c [5.6158]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.5068]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Nd2ScPdO6]
_chemical_formula_sum '[Nd4 Sc2 Pd2 O12]'
_cell_volume [269.0720]
_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  0.2468  0.5719  0.2221  1.0
  Sc  Sc1  2  0.0000  0.5547  0.5000  1.0
  Pd  Pd2  2  0.0000  0.0561  0.0000  1.0
  O  O3  4  0.0703  0.8109  0.8164  1.0
  O  O4  4  0.0716  0.3063  0.8314  1.0
  O  O5  4  0.2328  0.5130  0.6160  1.0
]