# generated using pymatgen
data_Sc8NiHg3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.57340958
_cell_length_b   9.57341022
_cell_length_c   6.49470896
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000123
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc8NiHg3
_chemical_formula_sum   'Sc16 Ni2 Hg6'
_cell_volume   515.49401672
_cell_formula_units_Z   2
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
  Sc  Sc0  1  0.53353172  0.06706344  0.52722585  1.0
  Sc  Sc1  1  0.93293656  0.46646828  0.52722585  1.0
  Sc  Sc2  1  0.53353172  0.46646828  0.52722585  1.0
  Sc  Sc3  1  0.46646828  0.93293656  0.02722585  1.0
  Sc  Sc4  1  0.06706344  0.53353172  0.02722585  1.0
  Sc  Sc5  1  0.46646828  0.53353172  0.02722585  1.0
  Sc  Sc6  1  0.17465215  0.34930429  0.72401747  1.0
  Sc  Sc7  1  0.65069571  0.82534785  0.72401747  1.0
  Sc  Sc8  1  0.17465215  0.82534785  0.72401747  1.0
  Sc  Sc9  1  0.82534785  0.65069571  0.22401747  1.0
  Sc  Sc10  1  0.34930429  0.17465215  0.22401747  1.0
  Sc  Sc11  1  0.82534785  0.17465215  0.22401747  1.0
  Sc  Sc12  1  0.66666700  0.33333300  0.91237762  1.0
  Sc  Sc13  1  0.33333300  0.66666700  0.41237762  1.0
  Sc  Sc14  1  0.00000000  0.00000000  0.50064805  1.0
  Sc  Sc15  1  0.00000000  0.00000000  0.00064805  1.0
  Ni  Ni16  1  0.66666700  0.33333300  0.28811952  1.0
  Ni  Ni17  1  0.33333300  0.66666700  0.78811952  1.0
  Hg  Hg18  1  0.83383454  0.66766908  0.77432194  1.0
  Hg  Hg19  1  0.33233092  0.16616546  0.77432194  1.0
  Hg  Hg20  1  0.83383454  0.16616546  0.77432194  1.0
  Hg  Hg21  1  0.16616546  0.33233092  0.27432194  1.0
  Hg  Hg22  1  0.66766908  0.83383454  0.27432194  1.0
  Hg  Hg23  1  0.16616546  0.83383454  0.27432194  1.0