# generated using pymatgen
data_PrNd(ThSe3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.45856920
_cell_length_b   4.14492812
_cell_length_c   11.25436097
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrNd(ThSe3)2
_chemical_formula_sum   'Pr2 Nd2 Th4 Se12'
_cell_volume   534.52526318
_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  0.30383235  0.25000000  0.50839375  1.0
  Pr  Pr1  1  0.80383235  0.25000000  0.99160625  1.0
  Nd  Nd2  1  0.48424574  0.25000000  0.18760463  1.0
  Nd  Nd3  1  0.98424574  0.25000000  0.31239537  1.0
  Th  Th4  1  0.51739077  0.75000000  0.81603817  1.0
  Th  Th5  1  0.01739077  0.75000000  0.68396183  1.0
  Th  Th6  1  0.69138492  0.75000000  0.49884373  1.0
  Th  Th7  1  0.19138492  0.75000000  0.00115627  1.0
  Se  Se8  1  0.55019223  0.25000000  0.62799261  1.0
  Se  Se9  1  0.05019223  0.25000000  0.87200739  1.0
  Se  Se10  1  0.45414955  0.75000000  0.37747890  1.0
  Se  Se11  1  0.95414955  0.75000000  0.12252110  1.0
  Se  Se12  1  0.62178530  0.75000000  0.05639629  1.0
  Se  Se13  1  0.12178530  0.75000000  0.44360371  1.0
  Se  Se14  1  0.37920240  0.25000000  0.94445844  1.0
  Se  Se15  1  0.87920240  0.25000000  0.55554156  1.0
  Se  Se16  1  0.72240514  0.25000000  0.30549437  1.0
  Se  Se17  1  0.22240514  0.25000000  0.19450563  1.0
  Se  Se18  1  0.27541362  0.75000000  0.70963303  1.0
  Se  Se19  1  0.77541362  0.75000000  0.79036697  1.0