# generated using pymatgen
data_Ho3ThHgIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.64430660
_cell_length_b   9.64430691
_cell_length_c   9.64430680
_cell_angle_alpha   60.00000038
_cell_angle_beta   59.99999933
_cell_angle_gamma   59.99999671
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ho3ThHgIr
_chemical_formula_sum   'Ho12 Th4 Hg4 Ir4'
_cell_volume   634.30485987
_cell_formula_units_Z   4
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
  Ho  Ho0  1  0.06117535  0.43882465  0.43882465  1.0
  Ho  Ho1  1  0.43882465  0.06117535  0.06117535  1.0
  Ho  Ho2  1  0.43882465  0.06117535  0.43882465  1.0
  Ho  Ho3  1  0.06117535  0.43882465  0.06117535  1.0
  Ho  Ho4  1  0.43882465  0.43882465  0.06117535  1.0
  Ho  Ho5  1  0.06117535  0.06117535  0.43882465  1.0
  Ho  Ho6  1  0.18582060  0.81417940  0.81417940  1.0
  Ho  Ho7  1  0.81417940  0.18582060  0.18582060  1.0
  Ho  Ho8  1  0.81417940  0.18582060  0.81417940  1.0
  Ho  Ho9  1  0.18582060  0.81417940  0.18582060  1.0
  Ho  Ho10  1  0.81417940  0.81417940  0.18582060  1.0
  Ho  Ho11  1  0.18582060  0.18582060  0.81417940  1.0
  Th  Th12  1  0.60181448  0.60181448  0.60181448  1.0
  Th  Th13  1  0.60181448  0.60181448  0.19455757  1.0
  Th  Th14  1  0.60181448  0.19455757  0.60181448  1.0
  Th  Th15  1  0.19455757  0.60181448  0.60181448  1.0
  Hg  Hg16  1  0.83938969  0.83938969  0.83938969  1.0
  Hg  Hg17  1  0.83938969  0.83938969  0.48182994  1.0
  Hg  Hg18  1  0.83938969  0.48182994  0.83938969  1.0
  Hg  Hg19  1  0.48182994  0.83938969  0.83938969  1.0
  Ir  Ir20  1  0.39262909  0.39262909  0.39262909  1.0
  Ir  Ir21  1  0.39262909  0.39262909  0.82211174  1.0
  Ir  Ir22  1  0.39262909  0.82211174  0.39262909  1.0
  Ir  Ir23  1  0.82211174  0.39262909  0.39262909  1.0