# generated using pymatgen
data_Tb4AsI6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.22159885
_cell_length_b   13.98827115
_cell_length_c   14.63980261
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb4AsI6
_chemical_formula_sum   'Tb8 As2 I12'
_cell_volume   864.52235058
_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  0.11611741  0.34732323  1.0
  Tb  Tb1  1  0.50000000  0.88388259  0.65267677  1.0
  Tb  Tb2  1  0.50000000  0.61611741  0.15267677  1.0
  Tb  Tb3  1  0.50000000  0.38388259  0.84732323  1.0
  Tb  Tb4  1  0.00000000  0.10915683  0.57549021  1.0
  Tb  Tb5  1  0.00000000  0.89084317  0.42450979  1.0
  Tb  Tb6  1  0.00000000  0.60915683  0.92450979  1.0
  Tb  Tb7  1  0.00000000  0.39084317  0.07549021  1.0
  As  As8  1  0.50000000  0.00000000  0.50000000  1.0
  As  As9  1  0.50000000  0.50000000  0.00000000  1.0
  I  I10  1  0.50000000  0.24992734  0.16636165  1.0
  I  I11  1  0.50000000  0.75007266  0.83363835  1.0
  I  I12  1  0.50000000  0.74992734  0.33363835  1.0
  I  I13  1  0.50000000  0.25007266  0.66636165  1.0
  I  I14  1  0.00000000  0.25895819  0.41744999  1.0
  I  I15  1  0.00000000  0.74104181  0.58255001  1.0
  I  I16  1  0.00000000  0.75895819  0.08255001  1.0
  I  I17  1  0.00000000  0.24104181  0.91744999  1.0
  I  I18  1  0.00000000  0.00102988  0.23878006  1.0
  I  I19  1  0.00000000  0.99897012  0.76121994  1.0
  I  I20  1  0.00000000  0.50102988  0.26121994  1.0
  I  I21  1  0.00000000  0.49897012  0.73878006  1.0