# generated using pymatgen
data_TbSc2(NiIr2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.20653048
_cell_length_b   5.20652934
_cell_length_c   8.57708458
_cell_angle_alpha   72.33121059
_cell_angle_beta   72.33119927
_cell_angle_gamma   60.00000200
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbSc2(NiIr2)3
_chemical_formula_sum   'Tb1 Sc2 Ni3 Ir6'
_cell_volume   188.58602091
_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
  Tb  Tb0  1  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc1  1  0.14143938  0.14143938  0.57568485  1.0
  Sc  Sc2  1  0.85856062  0.85856062  0.42431515  1.0
  Ni  Ni3  1  0.33321841  0.33321841  0.00034278  1.0
  Ni  Ni4  1  0.66678159  0.66678159  0.99965722  1.0
  Ni  Ni5  1  0.50000000  0.50000000  0.50000000  1.0
  Ir  Ir6  1  0.08159856  0.58485997  0.74868050  1.0
  Ir  Ir7  1  0.58485997  0.58485997  0.74868050  1.0
  Ir  Ir8  1  0.58485997  0.08159856  0.74868050  1.0
  Ir  Ir9  1  0.91840144  0.41514003  0.25131950  1.0
  Ir  Ir10  1  0.41514003  0.41514003  0.25131950  1.0
  Ir  Ir11  1  0.41514003  0.91840144  0.25131950  1.0