# generated using pymatgen
data_Tb5Pr3(SBr6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.04031260
_cell_length_b   13.31653787
_cell_length_c   13.85133365
_cell_angle_alpha   89.49815428
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb5Pr3(SBr6)2
_chemical_formula_sum   'Tb5 Pr3 S2 Br12'
_cell_volume   745.21438263
_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  0.11910430  0.34437292  1.0
  Tb  Tb1  1  0.50000000  0.88254334  0.65301257  1.0
  Tb  Tb2  1  0.50000000  0.61605464  0.15354383  1.0
  Tb  Tb3  1  0.50000000  0.38325474  0.84773402  1.0
  Tb  Tb4  1  0.00000000  0.38817705  0.07944294  1.0
  Pr  Pr5  1  0.00000000  0.11507408  0.57952093  1.0
  Pr  Pr6  1  0.00000000  0.88558420  0.41687916  1.0
  Pr  Pr7  1  0.00000000  0.61238143  0.92113771  1.0
  S  S8  1  0.50000000  0.00037375  0.49810101  1.0
  S  S9  1  0.50000000  0.49405528  0.00456796  1.0
  Br  Br10  1  0.50000000  0.25499642  0.16816298  1.0
  Br  Br11  1  0.50000000  0.75541753  0.82920470  1.0
  Br  Br12  1  0.50000000  0.73971507  0.32991141  1.0
  Br  Br13  1  0.50000000  0.25419622  0.67495500  1.0
  Br  Br14  1  0.00000000  0.25804198  0.40839310  1.0
  Br  Br15  1  0.00000000  0.74361519  0.58923286  1.0
  Br  Br16  1  0.00000000  0.75630957  0.09012965  1.0
  Br  Br17  1  0.00000000  0.24638485  0.92050337  1.0
  Br  Br18  1  0.00000000  0.01516839  0.23467435  1.0
  Br  Br19  1  0.00000000  0.98821650  0.76135582  1.0
  Br  Br20  1  0.00000000  0.50244189  0.25706662  1.0
  Br  Br21  1  0.00000000  0.48889159  0.73809609  1.0