data_K2LaBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.27
_cell_length_b   6.27
_cell_length_c   6.27
_cell_angle_alpha   127.08
_cell_angle_beta   127.08
_cell_angle_gamma   78.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2LaBi
_chemical_formula_sum   'K2 La1 Bi1'
_cell_volume   151.84
_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  K1  1  0.0  0.0  0.0  1.0
  K  K2  1  0.79  0.0  0.43  1.0
  La  La3  1  0.0  0.0  0.87  1.0
  Bi  Bi0  1  0.0  0.79  0.43  1.0

data_K2LaBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.59
_cell_length_b   5.59
_cell_length_c   6.27
_cell_angle_alpha   116.46
_cell_angle_beta   116.46
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2LaBi
_chemical_formula_sum   'K2 La1 Bi1'
_cell_volume   151.84
_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  0.0  0.0  0.0  1.0
  K  K1  1  0.43  0.64  0.64  1.0
  La  La2  1  0.87  0.87  0.87  1.0
  Bi  Bi3  1  0.64  0.43  0.64  1.0

K K La Bi