# generated using pymatgen
data_LiSc2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76807247
_cell_length_b   4.76821805
_cell_length_c   4.76624249
_cell_angle_alpha   59.98099349
_cell_angle_beta   59.98304886
_cell_angle_gamma   60.01099260
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSc2Au
_chemical_formula_sum   'Li1 Sc2 Au1'
_cell_volume   76.60869514
_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
  Li  Li0  1  0.75013909  0.75010601  0.74998186  1
  Sc  Sc1  1  0.00020377  0.00016791  0.99974690  1
  Sc  Sc2  1  0.50003192  0.49999779  0.50027134  1
  Au  Au3  1  0.24962423  0.24972829  0.24999890  1
