data_[Nd12Co4Ge2Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Co  1.8800  1.3500  0.7683
  Ge  2.0100  1.2500  0.7700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.3613]
_cell_length_b [4.1118]
_cell_length_c [9.0641]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6290]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd6Co2GeBr3]
_chemical_formula_sum '[Nd12 Co4 Ge2 Br6]'
_cell_volume [679.6606]
_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  0.0226  0.0000  0.2423  1.0
  Nd  Nd1  4  0.1628  0.5000  0.1338  1.0
  Nd  Nd2  4  0.1801  0.5000  0.5576  1.0
  Co  Co3  4  0.1708  0.0000  0.3444  1.0
  Ge  Ge4  2  0.0000  0.5000  0.0000  1.0
  Br  Br5  4  0.1611  0.0000  0.8413  1.0
  Br  Br6  2  0.0000  0.5000  0.5000  1.0
]