data_[Nd12Os2Au4]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9362]
_cell_length_b [7.6245]
_cell_length_c [12.3520]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.2777]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Nd6OsAu2]
_chemical_formula_sum '[Nd12 Os2 Au4]'
_cell_volume [558.2954]
_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  0.1105  0.6866  0.9366  1
  Nd  Nd1  4  0.2573  0.1829  0.9315  1
  Nd  Nd2  4  0.3932  0.5349  0.7487  1
  Os  Os3  2  0.5000  0.0000  0.5000  1
  Au  Au4  4  0.1816  0.6094  0.2370  1
]