data_KAlBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.1
_cell_length_b   6.1
_cell_length_c   6.1
_cell_angle_alpha   132.32
_cell_angle_beta   132.32
_cell_angle_gamma   69.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlBi2
_chemical_formula_sum   'K1 Al1 Bi2'
_cell_volume   122.0
_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
  K  K3  1  0.0  0.47  0.5  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.47  0.0  0.5  1.0
  Bi  Bi2  1  0.0  0.0  0.01  1.0

data_KAlBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.94
_cell_length_b   4.94
_cell_length_c   6.1
_cell_angle_alpha   113.84
_cell_angle_beta   113.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlBi2
_chemical_formula_sum   'K1 Al1 Bi2'
_cell_volume   122.0
_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
  K  K0  1  0.04  0.5  0.04  1.0
  Al  Al1  1  0.0  0.0  0.0  1.0
  Bi  Bi2  1  0.01  0.01  0.01  1.0
  Bi  Bi3  1  0.5  0.04  0.04  1.0

K Al Bi Bi