# generated using pymatgen
data_Th5Pb4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.62073569
_cell_length_b   9.84138664
_cell_length_c   9.84136347
_cell_angle_alpha   120.00058666
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th5Pb4
_chemical_formula_sum   'Th10 Pb8'
_cell_volume   555.32328139
_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
  Th  Th0  1  0.49999900  0.33333303  0.66666505  1.0
  Th  Th1  1  0.50000000  0.66666797  0.33333495  1.0
  Th  Th2  1  0.00000000  0.66666697  0.33333495  1.0
  Th  Th3  1  0.00000000  0.33333203  0.66666505  1.0
  Th  Th4  1  0.74999900  0.28085889  0.00000000  1.0
  Th  Th5  1  0.75000000  0.71914047  0.71913993  1.0
  Th  Th6  1  0.75000000  0.00000154  0.28086007  1.0
  Th  Th7  1  0.24999900  0.71914111  -0.00000000  1.0
  Th  Th8  1  0.25000000  0.28085953  0.28086007  1.0
  Th  Th9  1  0.25000000  0.99999846  0.71913993  1.0
  Pb  Pb10  1  0.50000000  0.00000000  0.00000000  1.0
  Pb  Pb11  1  -0.00000000  0.00000000  0.00000000  1.0
  Pb  Pb12  1  0.74999900  0.61965614  -0.00000000  1.0
  Pb  Pb13  1  0.75000100  0.38034581  0.38034243  1.0
  Pb  Pb14  1  0.75000100  0.00000339  0.61965757  1.0
  Pb  Pb15  1  0.24999900  0.38034386  0.00000000  1.0
  Pb  Pb16  1  0.25000100  0.61965419  0.61965757  1.0
  Pb  Pb17  1  0.25000100  -0.00000339  0.38034243  1.0