# generated using pymatgen
data_Th10Bi3Pb3S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56438095
_cell_length_b   9.56438151
_cell_length_c   6.63840198
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000154
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th10Bi3Pb3S2
_chemical_formula_sum   'Th10 Bi3 Pb3 S2'
_cell_volume   525.90576152
_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
  Th  Th0  1  0.74896494  0.74896494  0.75000000  1.0
  Th  Th1  1  0.25103506  0.00000000  0.75000000  1.0
  Th  Th2  1  1.00000000  0.25103506  0.75000000  1.0
  Th  Th3  1  0.25073825  0.25073825  0.25000000  1.0
  Th  Th4  1  0.74926175  1.00000000  0.25000000  1.0
  Th  Th5  1  0.00000000  0.74926175  0.25000000  1.0
  Th  Th6  1  0.66666700  0.33333300  0.00258465  1.0
  Th  Th7  1  0.33333300  0.66666700  0.00258465  1.0
  Th  Th8  1  0.33333300  0.66666700  0.49741535  1.0
  Th  Th9  1  0.66666700  0.33333300  0.49741535  1.0
  Bi  Bi10  1  0.39308132  0.39308132  0.75000000  1.0
  Bi  Bi11  1  0.60691868  0.00000000  0.75000000  1.0
  Bi  Bi12  1  1.00000000  0.60691868  0.75000000  1.0
  Pb  Pb13  1  0.60832719  0.60832719  0.25000000  1.0
  Pb  Pb14  1  0.39167281  1.00000000  0.25000000  1.0
  Pb  Pb15  1  0.00000000  0.39167281  0.25000000  1.0
  S  S16  1  0.00000000  0.00000000  0.99969227  1.0
  S  S17  1  0.00000000  0.00000000  0.50030773  1.0