# generated using pymatgen
data_Tb4PI6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.18489158
_cell_length_b   13.93908863
_cell_length_c   14.56003052
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb4PI6
_chemical_formula_sum   'Tb8 P2 I12'
_cell_volume   849.33862671
_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  0.50000000  0.11606785  0.35171864  1.0
  Tb  Tb1  1  0.50000000  0.88393215  0.64828136  1.0
  Tb  Tb2  1  0.50000000  0.61606785  0.14828136  1.0
  Tb  Tb3  1  0.50000000  0.38393215  0.85171864  1.0
  Tb  Tb4  1  0.00000000  0.10491701  0.57548057  1.0
  Tb  Tb5  1  0.00000000  0.89508299  0.42451943  1.0
  Tb  Tb6  1  0.00000000  0.60491701  0.92451943  1.0
  Tb  Tb7  1  0.00000000  0.39508299  0.07548057  1.0
  P  P8  1  0.50000000  0.00000000  0.50000000  1.0
  P  P9  1  0.50000000  0.50000000  0.00000000  1.0
  I  I10  1  0.50000000  0.25404752  0.16943817  1.0
  I  I11  1  0.50000000  0.74595248  0.83056183  1.0
  I  I12  1  0.50000000  0.75404752  0.33056183  1.0
  I  I13  1  0.50000000  0.24595248  0.66943817  1.0
  I  I14  1  0.00000000  0.26003656  0.42196485  1.0
  I  I15  1  0.00000000  0.73996344  0.57803515  1.0
  I  I16  1  0.00000000  0.76003656  0.07803515  1.0
  I  I17  1  0.00000000  0.23996344  0.92196485  1.0
  I  I18  1  0.00000000  0.00467962  0.23827705  1.0
  I  I19  1  0.00000000  0.99532038  0.76172295  1.0
  I  I20  1  0.00000000  0.50467962  0.26172295  1.0
  I  I21  1  0.00000000  0.49532038  0.73827705  1.0