data_[Na4Li4Fe4N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Li  0.9800  1.4500  0.9000
  Fe  1.8300  1.4000  0.8525
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7279]
_cell_length_b [3.2407]
_cell_length_c [6.8177]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.9800]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaLiFeN2]
_chemical_formula_sum '[Na4 Li4 Fe4 N8]'
_cell_volume [233.4380]
_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
[
  Na  Na0  4  0.1343  0.5000  0.6431  1.0
  Li  Li1  4  0.1939  0.5000  0.0650  1.0
  Fe  Fe2  4  0.0542  0.0000  0.1758  1.0
  N  N3  4  0.0944  0.5000  0.2891  1.0
  N  N4  4  0.1145  0.0000  0.9325  1.0
]