data_[Nd24Os9Pd3Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Os  2.2000  1.3000  0.6730
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.2274]
_cell_length_b [8.2274]
_cell_length_c [22.6696]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Nd8Os3PdCl4]
_chemical_formula_sum '[Nd24 Os9 Pd3 Cl12]'
_cell_volume [1328.9120]
_cell_formula_units_Z [3]
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  18  0.0126  0.5063  0.7643  1.0
  Nd  Nd1  6  0.0000  0.0000  0.2357  1.0
  Os  Os2  9  0.0000  0.5000  0.5000  1.0
  Pd  Pd3  3  -0.0000  -0.0000  0.5000  1.0
  Cl  Cl4  9  0.0000  0.5000  0.0000  1.0
  Cl  Cl5  3  0.0000  0.0000  0.0000  1.0
]