data_[Cd4Bi4N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [12.2848]
_cell_length_b [6.0024]
_cell_length_c [5.9030]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.4909]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CdBiN]
_chemical_formula_sum '[Cd4 Bi4 N4]'
_cell_volume [423.2694]
_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
[
  Cd  Cd0  4  0.4776  0.7500  0.9893  1.0
  Bi  Bi1  4  0.3157  0.0564  0.1606  1.0
  N  N2  4  0.0053  0.0604  0.5733  1.0
]