data_[Nd8Au2Br10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.8586]
_cell_length_b [4.1643]
_cell_length_c [8.8797]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9352]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd4AuBr5]
_chemical_formula_sum '[Nd8 Au2 Br10]'
_cell_volume [679.6552]
_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  0.0028  0.0000  0.2312  1.0
  Nd  Nd1  4  0.1580  0.5000  0.0780  1.0
  Au  Au2  2  0.0000  0.5000  0.0000  1.0
  Br  Br3  4  0.1686  0.0000  0.3271  1.0
  Br  Br4  4  0.1704  0.0000  0.8310  1.0
  Br  Br5  2  0.0000  0.5000  0.5000  1.0
]