# generated using pymatgen
data_SrTb6FeBr12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.12073246
_cell_length_b   9.12073171
_cell_length_c   9.12073356
_cell_angle_alpha   105.91855282
_cell_angle_beta   105.91855369
_cell_angle_gamma   105.91855157
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTb6FeBr12
_chemical_formula_sum   'Sr1 Tb6 Fe1 Br12'
_cell_volume   649.62073456
_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  0.09703170  0.01669731  0.30251714  1.0
  Tb  Tb2  1  0.30251714  0.09703170  0.01669731  1.0
  Tb  Tb3  1  0.01669731  0.30251714  0.09703170  1.0
  Tb  Tb4  1  0.90296830  0.98330269  0.69748286  1.0
  Tb  Tb5  1  0.69748286  0.90296830  0.98330269  1.0
  Tb  Tb6  1  0.98330269  0.69748286  0.90296830  1.0
  Fe  Fe7  1  0.00000000  0.00000000  0.00000000  1.0
  Br  Br8  1  0.07469603  0.67538214  0.22221088  1.0
  Br  Br9  1  0.22221088  0.07469603  0.67538214  1.0
  Br  Br10  1  0.67538214  0.22221088  0.07469603  1.0
  Br  Br11  1  0.92530397  0.32461786  0.77778912  1.0
  Br  Br12  1  0.77778912  0.92530397  0.32461786  1.0
  Br  Br13  1  0.32461786  0.77778912  0.92530397  1.0
  Br  Br14  1  0.44654148  0.13704594  0.36323060  1.0
  Br  Br15  1  0.36323060  0.44654148  0.13704594  1.0
  Br  Br16  1  0.13704594  0.36323060  0.44654148  1.0
  Br  Br17  1  0.55345852  0.86295406  0.63676940  1.0
  Br  Br18  1  0.63676940  0.55345852  0.86295406  1.0
  Br  Br19  1  0.86295406  0.63676940  0.55345852  1.0