data_[Nd16Co2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Co  1.8800  1.3500  0.7683
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.7788]
_cell_length_b [5.1584]
_cell_length_c [7.0022]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.8094]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8CoPd2]
_chemical_formula_sum '[Nd16 Co2 Pd4]'
_cell_volume [632.7836]
_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  0.0295  0.0000  0.7837  1.0
  Nd  Nd1  4  0.0877  0.5000  0.4414  1.0
  Nd  Nd2  4  0.1591  0.5000  0.9720  1.0
  Nd  Nd3  4  0.2034  0.0000  0.3315  1.0
  Co  Co4  2  0.0000  0.5000  0.0000  1.0
  Pd  Pd5  4  0.1981  0.0000  0.7422  1.0
]