data_[Nd4N4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.3520]
_cell_length_b [5.4536]
_cell_length_c [9.5395]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [NdNO4]
_chemical_formula_sum '[Nd4 N4 O16]'
_cell_volume [382.4819]
_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  0.2103  0.7500  0.6580  1
  N  N1  4  0.2045  0.7500  0.3417  1
  O  O2  8  0.1773  0.5490  0.4058  1
  O  O3  4  0.0021  0.2500  0.1851  1
  O  O4  4  0.2395  0.2500  0.7160  1
]