data_LaAlBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03
_cell_length_b   6.03
_cell_length_c   6.03
_cell_angle_alpha   134.1
_cell_angle_beta   131.3
_cell_angle_gamma   69.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAlBi2
_chemical_formula_sum   'La1 Al1 Bi2'
_cell_volume   116.33
_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  La3  1  0.0  0.0  0.97  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.35  0.0  0.45  1.0
  Bi  Bi2  1  0.0  0.49  0.52  1.0

data_LaAlBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.71
_cell_length_b   4.98
_cell_length_c   6.03
_cell_angle_alpha   114.35
_cell_angle_beta   112.95
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAlBi2
_chemical_formula_sum   'La1 Al1 Bi2'
_cell_volume   116.33
_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  0.0  0.97  0.97  1.0
  Al  Al1  1  0.0  0.0  0.0  1.0
  Bi  Bi2  1  0.0  0.45  0.1  1.0
  Bi  Bi3  1  0.51  0.03  0.03  1.0

La Al Bi Bi