# generated using pymatgen
data_Tb5Pr2ThS12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95953658
_cell_length_b   10.50621730
_cell_length_c   10.81017457
_cell_angle_alpha   89.79148533
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb5Pr2ThS12
_chemical_formula_sum   'Tb5 Pr2 Th1 S12'
_cell_volume   449.69759976
_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  0.25000000  0.50520968  0.30749785  1.0
  Tb  Tb1  1  0.25000000  0.19033476  0.48530515  1.0
  Tb  Tb2  1  0.75000000  0.81117386  0.50817373  1.0
  Tb  Tb3  1  0.75000000  0.68338706  0.01186021  1.0
  Tb  Tb4  1  0.25000000  0.31598995  0.99543798  1.0
  Pr  Pr5  1  0.75000000  0.00006755  0.19633576  1.0
  Pr  Pr6  1  0.75000000  0.49340594  0.69286672  1.0
  Th  Th7  1  0.25000000  0.00299955  0.80564267  1.0
  S  S8  1  0.25000000  0.28976029  0.73203768  1.0
  S  S9  1  0.75000000  0.69953713  0.27069214  1.0
  S  S10  1  0.75000000  0.80341167  0.77211796  1.0
  S  S11  1  0.25000000  0.20248124  0.22864737  1.0
  S  S12  1  0.25000000  0.94580639  0.38739124  1.0
  S  S13  1  0.75000000  0.05501141  0.61447004  1.0
  S  S14  1  0.75000000  0.44583209  0.12206826  1.0
  S  S15  1  0.25000000  0.55436583  0.88466606  1.0
  S  S16  1  0.25000000  0.86798595  0.03993379  1.0
  S  S17  1  0.75000000  0.13165787  0.95325310  1.0
  S  S18  1  0.75000000  0.37181144  0.44956975  1.0
  S  S19  1  0.25000000  0.62977333  0.54203354  1.0