data_La2HfGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99
_cell_length_b   5.99
_cell_length_c   5.55
_cell_angle_alpha   100.73
_cell_angle_beta   100.73
_cell_angle_gamma   32.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2HfGe
_chemical_formula_sum   'La2 Hf1 Ge1'
_cell_volume   105.58
_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  La2  1  0.25  0.0  0.22  1.0
  La  La3  1  0.16  0.0  0.22  1.0
  Hf  Hf1  1  0.2  0.0  0.72  1.0
  Ge  Ge0  1  0.0  0.0  0.0  1.0

data_La2HfGe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.38
_cell_length_b   5.55
_cell_length_c   5.99
_cell_angle_alpha   100.73
_cell_angle_beta   106.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2HfGe
_chemical_formula_sum   'La2 Hf1 Ge1'
_cell_volume   105.58
_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  0.22  0.16  1.0
  La  La1  1  0.0  0.22  0.25  1.0
  Hf  Hf2  1  0.0  0.72  0.2  1.0
  Ge  Ge3  1  0.0  0.0  0.0  1.0

La La Hf Ge