data_[Nd12Ge4Rh2Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ge  2.0100  1.2500  0.7700
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.0623]
_cell_length_b [4.2170]
_cell_length_c [9.0114]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9863]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd6Ge2RhBr3]
_chemical_formula_sum '[Nd12 Ge4 Rh2 Br6]'
_cell_volume [699.7555]
_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  0.0066  0.0000  0.2191  1.0
  Nd  Nd1  4  0.1514  0.5000  0.1053  1.0
  Nd  Nd2  4  0.1752  0.5000  0.5657  1.0
  Ge  Ge3  4  0.1650  0.0000  0.3385  1.0
  Rh  Rh4  2  0.0000  0.5000  0.0000  1.0
  Br  Br5  4  0.1738  0.0000  0.8367  1.0
  Br  Br6  2  0.0000  0.5000  0.5000  1.0
]