# generated using pymatgen
data_Tb7BeI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.66410318
_cell_length_b   9.66410402
_cell_length_c   9.66410429
_cell_angle_alpha   107.56771395
_cell_angle_beta   107.56771581
_cell_angle_gamma   107.56771709
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb7BeI12
_chemical_formula_sum   'Tb7 Be1 I12'
_cell_volume   739.72601787
_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  0.09881772  0.02880293  0.30051541  1.0
  Tb  Tb1  1  0.30051541  0.09881772  0.02880293  1.0
  Tb  Tb2  1  0.02880293  0.30051541  0.09881772  1.0
  Tb  Tb3  1  0.90118228  0.97119707  0.69948459  1.0
  Tb  Tb4  1  0.69948459  0.90118228  0.97119707  1.0
  Tb  Tb5  1  0.97119707  0.69948459  0.90118228  1.0
  Tb  Tb6  1  0.50000000  0.50000000  0.50000000  1.0
  Be  Be7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.07676662  0.68271473  0.22945907  1.0
  I  I9  1  0.22945907  0.07676662  0.68271473  1.0
  I  I10  1  0.68271473  0.22945907  0.07676662  1.0
  I  I11  1  0.92323338  0.31728527  0.77054093  1.0
  I  I12  1  0.77054093  0.92323338  0.31728527  1.0
  I  I13  1  0.31728527  0.77054093  0.92323338  1.0
  I  I14  1  0.46922564  0.15555490  0.38892055  1.0
  I  I15  1  0.38892055  0.46922564  0.15555490  1.0
  I  I16  1  0.15555490  0.38892055  0.46922564  1.0
  I  I17  1  0.53077436  0.84444510  0.61107945  1.0
  I  I18  1  0.61107945  0.53077436  0.84444510  1.0
  I  I19  1  0.84444510  0.61107945  0.53077436  1.0