# generated using pymatgen
data_Pr3Th2Bi3Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.66350355
_cell_length_b   9.66350311
_cell_length_c   6.64380403
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999810
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3Th2Bi3Cl
_chemical_formula_sum   'Pr6 Th4 Bi6 Cl2'
_cell_volume   537.29977033
_cell_formula_units_Z   2
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
  Pr  Pr0  1  0.27002367  0.00000000  0.75000000  1.0
  Pr  Pr1  1  0.72997633  1.00000000  0.25000000  1.0
  Pr  Pr2  1  0.00000000  0.27002367  0.75000000  1.0
  Pr  Pr3  1  1.00000000  0.72997633  0.25000000  1.0
  Pr  Pr4  1  0.72997633  0.72997633  0.75000000  1.0
  Pr  Pr5  1  0.27002367  0.27002367  0.25000000  1.0
  Th  Th6  1  0.33333300  0.66666700  0.50000000  1.0
  Th  Th7  1  0.66666700  0.33333300  0.50000000  1.0
  Th  Th8  1  0.66666700  0.33333300  0.00000000  1.0
  Th  Th9  1  0.33333300  0.66666700  0.00000000  1.0
  Bi  Bi10  1  0.61634991  0.00000000  0.75000000  1.0
  Bi  Bi11  1  0.38365009  1.00000000  0.25000000  1.0
  Bi  Bi12  1  0.00000000  0.61634991  0.75000000  1.0
  Bi  Bi13  1  1.00000000  0.38365009  0.25000000  1.0
  Bi  Bi14  1  0.38365009  0.38365009  0.75000000  1.0
  Bi  Bi15  1  0.61634991  0.61634991  0.25000000  1.0
  Cl  Cl16  1  0.00000000  0.00000000  0.50000000  1.0
  Cl  Cl17  1  0.00000000  0.00000000  0.00000000  1.0