data_[Nd2Cl6O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [6.7092]
_cell_length_b [8.0177]
_cell_length_c [7.4343]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.3912]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Nd(ClO2)3]
_chemical_formula_sum '[Nd2 Cl6 O12]'
_cell_volume [361.2776]
_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  2  0.0000  0.1116  0.7500  1
  Cl  Cl1  4  0.3216  0.1719  0.3315  1
  Cl  Cl2  2  0.5000  0.3667  0.7500  1
  O  O3  4  0.0629  0.4648  0.9703  1
  O  O4  4  0.1199  0.1081  0.1116  1
  O  O5  4  0.3585  0.2579  0.8282  1
]