# generated using pymatgen
data_Tb4MoI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.41849200
_cell_length_b   11.41849203
_cell_length_c   6.01635155
_cell_angle_alpha   89.94055978
_cell_angle_beta   89.94055528
_cell_angle_gamma   89.92336510
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb4MoI4
_chemical_formula_sum   'Tb8 Mo2 I8'
_cell_volume   784.42216144
_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  0.20486649  0.91525989  0.99993534  1.0
  Tb  Tb1  1  0.79513351  0.08474011  0.00006466  1.0
  Tb  Tb2  1  0.08474011  0.79513351  0.50006466  1.0
  Tb  Tb3  1  0.91525989  0.20486649  0.49993534  1.0
  Tb  Tb4  1  0.79530321  0.91549211  0.50033511  1.0
  Tb  Tb5  1  0.20469679  0.08450789  0.49966489  1.0
  Tb  Tb6  1  0.08450789  0.20469679  0.99966489  1.0
  Tb  Tb7  1  0.91549211  0.79530321  0.00033511  1.0
  Mo  Mo8  1  0.99997901  0.00002099  0.25000000  1.0
  Mo  Mo9  1  0.00002099  0.99997901  0.75000000  1.0
  I  I10  1  0.35778488  0.85135939  0.49912852  1.0
  I  I11  1  0.64221512  0.14864061  0.50087148  1.0
  I  I12  1  0.14864061  0.64221512  0.00087148  1.0
  I  I13  1  0.85135939  0.35778488  0.99912852  1.0
  I  I14  1  0.35786584  0.14831449  0.99984447  1.0
  I  I15  1  0.64213416  0.85168551  0.00015553  1.0
  I  I16  1  0.85168551  0.64213416  0.50015553  1.0
  I  I17  1  0.14831449  0.35786584  0.49984447  1.0