# generated using pymatgen
data_TbHf(SnIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.40855766
_cell_length_b   7.40855630
_cell_length_c   7.61440470
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001043
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbHf(SnIr)2
_chemical_formula_sum   'Tb3 Hf3 Sn6 Ir6'
_cell_volume   361.93767472
_cell_formula_units_Z   3
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  0.99999269  0.40678797  0.75000000  1.0
  Tb  Tb1  1  0.59321203  0.59320473  0.75000000  1.0
  Tb  Tb2  1  0.40679527  0.00000731  0.75000000  1.0
  Hf  Hf3  1  0.99976947  0.39076670  0.25000000  1.0
  Hf  Hf4  1  0.60923330  0.60900376  0.25000000  1.0
  Hf  Hf5  1  0.39099624  0.00023053  0.25000000  1.0
  Sn  Sn6  1  0.26610837  0.26627980  0.49279095  1.0
  Sn  Sn7  1  0.00016944  0.73389163  0.49279095  1.0
  Sn  Sn8  1  0.00016944  0.73389163  0.00720905  1.0
  Sn  Sn9  1  0.73372020  0.99983056  0.49279095  1.0
  Sn  Sn10  1  0.73372020  0.99983056  0.00720905  1.0
  Sn  Sn11  1  0.26610837  0.26627980  0.00720905  1.0
  Ir  Ir12  1  0.33333300  0.66666700  0.45867074  1.0
  Ir  Ir13  1  0.66666700  0.33333300  0.45917675  1.0
  Ir  Ir14  1  0.33333300  0.66666700  0.04132926  1.0
  Ir  Ir15  1  0.00000000  0.00000000  0.75000000  1.0
  Ir  Ir16  1  0.00000000  0.00000000  0.25000000  1.0
  Ir  Ir17  1  0.66666700  0.33333300  0.04082325  1.0