# generated using pymatgen
data_Tb8GeSBr12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03333024
_cell_length_b   13.16018672
_cell_length_c   13.80153546
_cell_angle_alpha   89.97399482
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb8GeSBr12
_chemical_formula_sum   'Tb8 Ge1 S1 Br12'
_cell_volume   732.57685682
_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  0.50000000  0.12441315  0.34136545  1.0
  Tb  Tb1  1  0.50000000  0.87558685  0.65863455  1.0
  Tb  Tb2  1  0.50000000  0.61724026  0.15254238  1.0
  Tb  Tb3  1  0.50000000  0.38275974  0.84745762  1.0
  Tb  Tb4  1  0.00000000  0.11716739  0.58371081  1.0
  Tb  Tb5  1  0.00000000  0.88283261  0.41628919  1.0
  Tb  Tb6  1  0.00000000  0.60885007  0.92383451  1.0
  Tb  Tb7  1  0.00000000  0.39114993  0.07616549  1.0
  Ge  Ge8  1  0.50000000  0.00000000  0.50000000  1.0
  S  S9  1  0.50000000  0.50000000  0.00000000  1.0
  Br  Br10  1  0.50000000  0.25716478  0.16502899  1.0
  Br  Br11  1  0.50000000  0.74283522  0.83497101  1.0
  Br  Br12  1  0.50000000  0.74732321  0.32794921  1.0
  Br  Br13  1  0.50000000  0.25267679  0.67205079  1.0
  Br  Br14  1  0.00000000  0.26033284  0.41673417  1.0
  Br  Br15  1  0.00000000  0.73966716  0.58326583  1.0
  Br  Br16  1  0.00000000  0.75520590  0.08257509  1.0
  Br  Br17  1  0.00000000  0.24479410  0.91742491  1.0
  Br  Br18  1  0.00000000  0.00973166  0.23789241  1.0
  Br  Br19  1  0.00000000  0.99026834  0.76210759  1.0
  Br  Br20  1  0.00000000  0.50507911  0.25711747  1.0
  Br  Br21  1  0.00000000  0.49492089  0.74288253  1.0