data_[Nd8Ta4Cr4N20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ta  1.5000  1.4500  0.8200
  Cr  1.6600  1.4000  0.9400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.2924]
_cell_length_b [14.1811]
_cell_length_c [10.2430]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Nd2TaCrN5]
_chemical_formula_sum '[Nd8 Ta4 Cr4 N20]'
_cell_volume [478.2470]
_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  0.1163  0.6883  1
  Nd  Nd1  4  0.0000  0.1319  0.3188  1
  Ta  Ta2  4  0.0000  0.2088  0.0228  1
  Cr  Cr3  4  0.0000  0.4513  0.4437  1
  N  N4  4  0.0000  0.0386  0.0220  1
  N  N5  4  0.0000  0.2957  0.6547  1
  N  N6  4  0.0000  0.3220  0.3828  1
  N  N7  4  0.0000  0.3434  0.0045  1
  N  N8  4  0.0000  0.4982  0.7864  1
]