data_AlBi2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68
_cell_length_b   6.68
_cell_length_c   6.68
_cell_angle_alpha   146.33
_cell_angle_beta   136.34
_cell_angle_gamma   56.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlBi2Sb
_chemical_formula_sum   'Al1 Bi2 Sb1'
_cell_volume   113.48
_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
  Al  Al0  1  0.0  0.0  0.85  1.0
  Bi  Bi1  1  0.94  0.0  0.25  1.0
  Bi  Bi2  1  0.0  0.0  0.86  1.0
  Sb  Sb3  1  0.94  0.0  0.73  1.0

data_AlBi2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.87
_cell_length_b   4.97
_cell_length_c   6.68
_cell_angle_alpha   111.83
_cell_angle_beta   106.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlBi2Sb
_chemical_formula_sum   'Al1 Bi2 Sb1'
_cell_volume   113.48
_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
  Al  Al0  1  0.15  0.15  0.15  1.0
  Bi  Bi1  1  0.14  0.14  0.14  1.0
  Bi  Bi2  1  0.69  0.75  0.69  1.0
  Sb  Sb3  1  0.21  0.27  0.21  1.0

Al Bi Bi Sb