data_[La6Fe2Bi2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Fe  1.8300  1.4000  0.8525
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.5513]
_cell_length_b [8.6286]
_cell_length_c [8.6971]
_cell_angle_alpha [119.1203]
_cell_angle_beta [90.1769]
_cell_angle_gamma [89.9929]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [La3FeBi]
_chemical_formula_sum '[La6 Fe2 Bi2]'
_cell_volume [298.3708]
_cell_formula_units_Z [2]
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  0.1051  0.6737  0.0343  1.0
  La  La1  1  0.1059  0.0550  0.6241  1.0
  La  La2  1  0.1075  0.2321  0.1826  1.0
  La  La3  1  0.6039  0.8961  0.8564  1.0
  La  La4  1  0.6068  0.4332  0.5996  1.0
  La  La5  1  0.6128  0.6452  0.3737  1.0
  Fe  Fe6  1  0.1009  0.7872  0.7598  1.0
  Fe  Fe7  1  0.1109  0.5496  0.4784  1.0
  Bi  Bi8  1  0.6060  0.9946  0.2986  1.0
  Bi  Bi9  1  0.6061  0.3333  0.9324  1.0
]