# generated using pymatgen
data_Y10Hg3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.69750195
_cell_length_b   9.69743958
_cell_length_c   9.61970303
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00026085
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y10Hg3Ir
_chemical_formula_sum   'Y20 Hg6 Ir2'
_cell_volume   783.44427795
_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
  Y  Y0  1  0.00000000  0.00000000  0.50000000  1.0
  Y  Y1  1  0.00000000  0.00000000  0.00000000  1.0
  Y  Y2  1  0.20836890  0.79163110  0.43868045  1.0
  Y  Y3  1  0.20840212  0.41674172  0.43866666  1.0
  Y  Y4  1  0.58325728  0.79159688  0.43866766  1.0
  Y  Y5  1  0.79163110  0.20836890  0.56131955  1.0
  Y  Y6  1  0.79159788  0.58325828  0.56133334  1.0
  Y  Y7  1  0.41674272  0.20840312  0.56133234  1.0
  Y  Y8  1  0.79163110  0.20836890  0.93868045  1.0
  Y  Y9  1  0.79159788  0.58325828  0.93866666  1.0
  Y  Y10  1  0.41674272  0.20840312  0.93866766  1.0
  Y  Y11  1  0.20836890  0.79163110  0.06131955  1.0
  Y  Y12  1  0.20840212  0.41674172  0.06133334  1.0
  Y  Y13  1  0.58325728  0.79159688  0.06133234  1.0
  Y  Y14  1  0.54124143  0.45875657  0.25000000  1.0
  Y  Y15  1  0.54126926  0.08252610  0.25000000  1.0
  Y  Y16  1  0.91747290  0.45873074  0.25000000  1.0
  Y  Y17  1  0.45875857  0.54124343  0.75000000  1.0
  Y  Y18  1  0.45873074  0.91747390  0.75000000  1.0
  Y  Y19  1  0.08252710  0.54126926  0.75000000  1.0
  Hg  Hg20  1  0.88010125  0.11990075  0.25000000  1.0
  Hg  Hg21  1  0.88007884  0.76016686  0.25000000  1.0
  Hg  Hg22  1  0.23983314  0.11992016  0.25000000  1.0
  Hg  Hg23  1  0.11989875  0.88009925  0.75000000  1.0
  Hg  Hg24  1  0.11992116  0.23983314  0.75000000  1.0
  Hg  Hg25  1  0.76016686  0.88007984  0.75000000  1.0
  Ir  Ir26  1  0.33334996  0.66664904  0.25000000  1.0
  Ir  Ir27  1  0.66665004  0.33335096  0.75000000  1.0