[CIF]
data_LiHf2Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46135558
_cell_length_b   5.46135558
_cell_length_c   3.08037213
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   115.95433994
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHf2Mg
_chemical_formula_sum   'Li1 Hf2 Mg1'
_cell_volume   82.61005503
_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
  Hf  Hf0  1  1.44796138  -2.31516933  1.54018606  1
  Hf  Hf1  1  1.44796138  2.31516933  1.54018606  1
  Li  Li2  1  0.00000000  0.00000000  0.00000000  1
  Mg  Mg3  1  2.89592276  0.00000000  0.00000000  1
[/CIF]
