data_[Nd16Ga4Bi4N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [6.9169]
_cell_length_b [16.2752]
_cell_length_c [6.9480]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Nd4GaBiN]
_chemical_formula_sum '[Nd16 Ga4 Bi4 N4]'
_cell_volume [782.1629]
_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  8  0.2500  0.2500  0.0000  1.0
  Nd  Nd1  4  0.0000  0.0818  0.7500  1.0
  Nd  Nd2  4  0.0000  0.4086  0.7500  1.0
  Ga  Ga3  4  0.0000  0.1168  0.2500  1.0
  Bi  Bi4  4  0.0000  0.3955  0.2500  1.0
  N  N5  4  0.0000  0.2416  0.7500  1.0
]