data_[Nd12Co4C2Br6]
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
  C  2.5500  0.7000  0.3000
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9209]
_cell_length_b [11.9462]
_cell_length_c [7.9830]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2414]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd6Co2CBr3]
_chemical_formula_sum '[Nd12 Co4 C2 Br6]'
_cell_volume [630.3651]
_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  8  0.2183  0.1594  0.1851  1.0
  Nd  Nd1  4  0.2414  0.5000  0.1853  1.0
  Co  Co2  4  0.0000  0.3327  0.0000  1.0
  C  C3  2  0.0000  0.0000  0.0000  1.0
  Br  Br4  4  0.0000  0.1650  0.5000  1.0
  Br  Br5  2  0.0000  0.5000  0.5000  1.0
]