data_La2FeBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.88
_cell_length_b   6.88
_cell_length_c   6.88
_cell_angle_alpha   150.17
_cell_angle_beta   138.14
_cell_angle_gamma   52.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2FeBi
_chemical_formula_sum   'La2 Fe1 Bi1'
_cell_volume   107.31
_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  La2  1  0.77  0.0  0.69  1.0
  La  La3  1  0.0  0.0  0.27  1.0
  Fe  Fe1  1  0.0  0.0  0.18  1.0
  Bi  Bi0  1  0.77  0.0  0.38  1.0

data_La2FeBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   4.91
_cell_length_c   6.88
_cell_angle_alpha   110.93
_cell_angle_beta   104.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2FeBi
_chemical_formula_sum   'La2 Fe1 Bi1'
_cell_volume   107.31
_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  0.08  0.31  0.08  1.0
  La  La1  1  0.73  0.73  0.73  1.0
  Fe  Fe2  1  0.82  0.82  0.82  1.0
  Bi  Bi3  1  0.39  0.62  0.39  1.0

La La Fe Bi