data_[La6Cd2Fe1N1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cd  1.6900  1.5500  1.0900
  Fe  1.8300  1.4000  0.8525
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.3352]
_cell_length_b [7.3904]
_cell_length_c [7.4086]
_cell_angle_alpha [60.1083]
_cell_angle_beta [60.7985]
_cell_angle_gamma [89.8442]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [La6Cd2FeN]
_chemical_formula_sum '[La6 Cd2 Fe1 N1]'
_cell_volume [288.1967]
_cell_formula_units_Z [1]
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
[
  La  La0  1  0.1795  0.6889  0.0627  1.0
  La  La1  1  0.2531  0.1889  0.5176  1.0
  La  La2  1  0.2968  0.2176  0.9664  1.0
  La  La3  1  0.7088  0.7593  0.0248  1.0
  La  La4  1  0.7343  0.8108  0.4751  1.0
  La  La5  1  0.8232  0.3054  0.9332  1.0
  Cd  Cd6  1  0.2494  0.7542  0.4879  1.0
  Cd  Cd7  1  0.7536  0.2439  0.5064  1.0
  Fe  Fe8  1  0.5085  0.5283  0.0157  1.0
  N  N9  1  0.9968  0.0017  0.0051  1.0
]