data_La2BeSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.16
_cell_length_b   6.16
_cell_length_c   6.16
_cell_angle_alpha   136.87
_cell_angle_beta   136.87
_cell_angle_gamma   62.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2BeSb
_chemical_formula_sum   'La2 Be1 Sb1'
_cell_volume   108.1
_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  La1  1  0.27  0.0  0.63  1.0
  La  La2  1  0.0  0.0  0.27  1.0
  Be  Be0  1  0.0  0.0  0.0  1.0
  Sb  Sb3  1  0.0  0.27  0.63  1.0

data_La2BeSb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.53
_cell_length_b   4.53
_cell_length_c   6.16
_cell_angle_alpha   111.56
_cell_angle_beta   111.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2BeSb
_chemical_formula_sum   'La2 Be1 Sb1'
_cell_volume   108.1
_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  0.37  0.0  0.63  1.0
  La  La1  1  0.73  0.0  0.73  1.0
  Be  Be2  1  0.0  0.0  0.0  1.0
  Sb  Sb3  1  0.63  0.27  0.63  1.0

La La Be Sb