data_[Nd4B12O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.9112]
_cell_length_b [8.1749]
_cell_length_c [6.4384]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.8930]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nd(BO2)3]
_chemical_formula_sum '[Nd4 B12 O24]'
_cell_volume [417.1995]
_cell_formula_units_Z [4]
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  0.0000  0.2983  0.2500  1.0
  B  B1  8  0.2266  0.0670  0.0851  1.0
  B  B2  4  0.0000  0.2776  0.7500  1.0
  O  O3  8  0.1019  0.1858  0.9926  1.0
  O  O4  8  0.1047  0.3863  0.7113  1.0
  O  O5  8  0.2030  0.0881  0.5042  1.0
]