data_LaHfBe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.9
_cell_length_b   4.9
_cell_length_c   3.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   97.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaHfBe2
_chemical_formula_sum   'La1 Hf1 Be2'
_cell_volume   74.3
_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  0.0  1.0
  Hf  Hf2  1  0.24  0.0  0.0  1.0
  Be  Be0  1  0.62  0.84  0.56  1.0
  Be  Be1  1  0.62  0.16  0.56  1.0

data_LaHfBe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.12
_cell_length_b   4.9
_cell_length_c   4.9
_cell_angle_alpha   97.25
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaHfBe2
_chemical_formula_sum   'La1 Hf1 Be2'
_cell_volume   74.3
_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  0.0  0.0  1.0
  Hf  Hf1  1  -0.0  0.24  0.0  1.0
  Be  Be2  1  0.56  0.62  0.16  1.0
  Be  Be3  1  0.56  0.62  0.84  1.0

La Hf Be Be