# generated using pymatgen
data_Tb4AlIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.55689634
_cell_length_b   9.55689666
_cell_length_c   9.55689634
_cell_angle_alpha   120.00000230
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000230
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb4AlIr
_chemical_formula_sum   'Tb16 Al4 Ir4'
_cell_volume   617.21377899
_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
  Tb  Tb0  1  0.80607123  0.00000000  0.19392877  1.0
  Tb  Tb1  1  0.19392877  0.00000000  0.19392877  1.0
  Tb  Tb2  1  0.19392877  0.38785854  0.19392877  1.0
  Tb  Tb3  1  0.64911439  0.29822879  0.35088661  1.0
  Tb  Tb4  1  0.05265782  0.70177221  0.35088661  1.0
  Tb  Tb5  1  0.64911439  0.70177221  0.35088661  1.0
  Tb  Tb6  1  0.06105733  0.12211466  0.56105833  1.0
  Tb  Tb7  1  0.06105733  0.50000000  0.56105833  1.0
  Tb  Tb8  1  0.43894267  0.50000000  0.56105833  1.0
  Tb  Tb9  1  0.80607123  1.00000000  0.80607123  1.0
  Tb  Tb10  1  0.19392877  0.00000000  0.80607123  1.0
  Tb  Tb11  1  0.80607123  0.61214246  0.80607123  1.0
  Tb  Tb12  1  0.06105833  0.50000000  0.93894267  1.0
  Tb  Tb13  1  0.43894267  0.50000000  0.93894267  1.0
  Tb  Tb14  1  0.43894267  0.87788434  0.93894267  1.0
  Tb  Tb15  1  0.64911339  0.29822879  0.94734218  1.0
  Al  Al16  1  0.42306761  0.84613522  0.26920183  1.0
  Al  Al17  1  0.73079817  0.15386578  0.57693239  1.0
  Al  Al18  1  0.42306761  0.84613522  0.57693339  1.0
  Al  Al19  1  0.42306761  0.15386578  0.57693339  1.0
  Ir  Ir20  1  0.42307760  0.28205240  0.14102620  1.0
  Ir  Ir21  1  0.85897380  0.28205240  0.14102620  1.0
  Ir  Ir22  1  0.85897380  0.71794760  0.14102620  1.0
  Ir  Ir23  1  0.85897380  0.71794760  0.57692240  1.0