# generated using pymatgen
data_SrTb6FeI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.71721924
_cell_length_b   9.71721909
_cell_length_c   9.71721892
_cell_angle_alpha   106.29698744
_cell_angle_beta   106.29698858
_cell_angle_gamma   106.29697163
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTb6FeI12
_chemical_formula_sum   'Sr1 Tb6 Fe1 I12'
_cell_volume   778.32731991
_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
  Sr  Sr0  1  0.50000000  0.50000000  0.50000000  1.0
  Tb  Tb1  1  0.09102911  0.29036602  0.01928334  1.0
  Tb  Tb2  1  0.01928334  0.09102911  0.29036602  1.0
  Tb  Tb3  1  0.29036602  0.01928334  0.09102911  1.0
  Tb  Tb4  1  0.90897089  0.70963398  0.98071666  1.0
  Tb  Tb5  1  0.98071666  0.90897089  0.70963398  1.0
  Tb  Tb6  1  0.70963398  0.98071666  0.90897089  1.0
  Fe  Fe7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.44898288  0.36817733  0.13355260  1.0
  I  I9  1  0.13355260  0.44898288  0.36817733  1.0
  I  I10  1  0.36817733  0.13355260  0.44898288  1.0
  I  I11  1  0.55101712  0.63182267  0.86644740  1.0
  I  I12  1  0.86644740  0.55101712  0.63182267  1.0
  I  I13  1  0.63182267  0.86644740  0.55101712  1.0
  I  I14  1  0.77420600  0.32252021  0.92588631  1.0
  I  I15  1  0.92588631  0.77420600  0.32252021  1.0
  I  I16  1  0.32252021  0.92588631  0.77420600  1.0
  I  I17  1  0.22579400  0.67747979  0.07411369  1.0
  I  I18  1  0.07411369  0.22579400  0.67747979  1.0
  I  I19  1  0.67747979  0.07411369  0.22579400  1.0