data_La2BeBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.25
_cell_length_b   6.25
_cell_length_c   6.25
_cell_angle_alpha   136.87
_cell_angle_beta   136.87
_cell_angle_gamma   62.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2BeBi
_chemical_formula_sum   'La2 Be1 Bi1'
_cell_volume   112.51
_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  0.0  0.0  0.34  1.0
  La  La3  1  0.0  0.3  0.67  1.0
  Be  Be0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.3  0.0  0.67  1.0

data_La2BeBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.59
_cell_length_b   4.59
_cell_length_c   6.25
_cell_angle_alpha   111.57
_cell_angle_beta   111.57
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2BeBi
_chemical_formula_sum   'La2 Be1 Bi1'
_cell_volume   112.51
_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  0.63  0.3  0.63  1.0
  La  La1  1  0.66  0.0  0.66  1.0
  Be  Be2  1  0.0  0.0  0.0  1.0
  Bi  Bi3  1  0.33  0.0  0.63  1.0

La La Be Bi