# generated using pymatgen
data_Sc8Hg3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68370796
_cell_length_b   6.58121587
_cell_length_c   8.52770324
_cell_angle_alpha   89.86176426
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc8Hg3Ir
_chemical_formula_sum   'Sc8 Hg3 Ir1'
_cell_volume   262.86136512
_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
  Sc  Sc0  1  0.75000000  0.86362234  0.92304821  1.0
  Sc  Sc1  1  0.25000000  0.17421748  0.06515480  1.0
  Sc  Sc2  1  0.25000000  0.66341990  0.42401708  1.0
  Sc  Sc3  1  0.75000000  0.32354259  0.58746024  1.0
  Sc  Sc4  1  0.75000000  0.98283193  0.30175522  1.0
  Sc  Sc5  1  0.25000000  0.02101869  0.70174861  1.0
  Sc  Sc6  1  0.25000000  0.50095239  0.81557657  1.0
  Sc  Sc7  1  0.75000000  0.47087229  0.17650132  1.0
  Hg  Hg8  1  0.75000000  0.75816678  0.60190131  1.0
  Hg  Hg9  1  0.25000000  0.23364798  0.39828618  1.0
  Hg  Hg10  1  0.25000000  0.74641535  0.10139931  1.0
  Ir  Ir11  1  0.75000000  0.26129227  0.90315113  1.0