# generated using pymatgen
data_LiSc2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.83705394
_cell_length_b   11.83705394
_cell_length_c   11.83705394
_cell_angle_alpha   119.77898075
_cell_angle_beta   119.61579549
_cell_angle_gamma   90.52500075
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSc2Hg
_chemical_formula_sum   'Li1 Sc2 Hg1'
_cell_volume   1178.08594618
_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  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc1  1  0.00000000  0.25752700  0.25752700  1.0
  Sc  Sc2  1  0.00000000  0.74247300  0.74247300  1.0
  Hg  Hg3  1  0.00000000  0.50000000  0.50000000  1.0