data_[Nd16Cd4Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.1868]
_cell_length_b [5.4968]
_cell_length_c [7.1476]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.2523]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8Cd2Os]
_chemical_formula_sum '[Nd16 Cd4 Os2]'
_cell_volume [674.5831]
_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  0.0186  0.0000  0.7883  1.0
  Nd  Nd1  4  0.0928  0.5000  0.4171  1.0
  Nd  Nd2  4  0.1514  0.5000  0.9473  1.0
  Nd  Nd3  4  0.1992  0.0000  0.2799  1.0
  Cd  Cd4  4  0.1818  0.0000  0.7021  1.0
  Os  Os5  2  0.0000  0.5000  0.0000  1.0
]