# generated using pymatgen
data_SrTb6IrBr12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.20098958
_cell_length_b   9.20098934
_cell_length_c   9.20098908
_cell_angle_alpha   105.92256844
_cell_angle_beta   105.92256790
_cell_angle_gamma   105.92256705
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTb6IrBr12
_chemical_formula_sum   'Sr1 Tb6 Ir1 Br12'
_cell_volume   666.85655263
_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  0.31020070  0.10282126  0.01877360  1.0
  Tb  Tb2  1  0.01877360  0.31020070  0.10282126  1.0
  Tb  Tb3  1  0.10282126  0.01877360  0.31020070  1.0
  Tb  Tb4  1  0.68979930  0.89717874  0.98122640  1.0
  Tb  Tb5  1  0.98122640  0.68979930  0.89717874  1.0
  Tb  Tb6  1  0.89717874  0.98122640  0.68979930  1.0
  Ir  Ir7  1  0.00000000  0.00000000  0.00000000  1.0
  Br  Br8  1  0.67431385  0.21905956  0.07278711  1.0
  Br  Br9  1  0.07278711  0.67431385  0.21905956  1.0
  Br  Br10  1  0.21905956  0.07278711  0.67431385  1.0
  Br  Br11  1  0.32568615  0.78094044  0.92721289  1.0
  Br  Br12  1  0.92721289  0.32568615  0.78094044  1.0
  Br  Br13  1  0.78094044  0.92721289  0.32568615  1.0
  Br  Br14  1  0.44955647  0.14042038  0.36472662  1.0
  Br  Br15  1  0.36472662  0.44955647  0.14042038  1.0
  Br  Br16  1  0.14042038  0.36472662  0.44955647  1.0
  Br  Br17  1  0.55044353  0.85957962  0.63527338  1.0
  Br  Br18  1  0.63527338  0.55044353  0.85957962  1.0
  Br  Br19  1  0.85957962  0.63527338  0.55044353  1.0