# generated using pymatgen
data_Tb3HfIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.59425491
_cell_length_b   7.08932862
_cell_length_c   8.50120447
_cell_angle_alpha   90.54153110
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb3HfIr2
_chemical_formula_sum   'Tb6 Hf2 Ir4'
_cell_volume   276.87341684
_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
  Tb  Tb0  1  0.75000000  0.14628977  0.08072870  1.0
  Tb  Tb1  1  0.25000000  0.85371023  0.91927130  1.0
  Tb  Tb2  1  0.75000000  0.50634358  0.82239220  1.0
  Tb  Tb3  1  0.25000000  0.49365642  0.17760780  1.0
  Tb  Tb4  1  0.75000000  0.01933862  0.66883256  1.0
  Tb  Tb5  1  0.25000000  0.98066138  0.33116744  1.0
  Hf  Hf6  1  0.75000000  0.63740336  0.42632614  1.0
  Hf  Hf7  1  0.25000000  0.36259664  0.57367386  1.0
  Ir  Ir8  1  0.75000000  0.26960703  0.42273358  1.0
  Ir  Ir9  1  0.25000000  0.73039297  0.57726642  1.0
  Ir  Ir10  1  0.75000000  0.74389158  0.10849128  1.0
  Ir  Ir11  1  0.25000000  0.25610842  0.89150872  1.0