# generated using pymatgen
data_Nd4Dy(ThSe4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.15332089
_cell_length_b   11.12726911
_cell_length_c   11.39469565
_cell_angle_alpha   90.36084320
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4Dy(ThSe4)3
_chemical_formula_sum   'Nd4 Dy1 Th3 Se12'
_cell_volume   526.59677416
_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
  Nd  Nd0  1  0.75000000  0.50139955  0.69786440  1.0
  Nd  Nd1  1  0.75000000  0.00089939  0.19222979  1.0
  Nd  Nd2  1  0.25000000  0.50495889  0.30730535  1.0
  Nd  Nd3  1  0.25000000  0.98971291  0.80704161  1.0
  Dy  Dy4  1  0.75000000  0.68848977  0.01365777  1.0
  Th  Th5  1  0.25000000  0.18780179  0.48513295  1.0
  Th  Th6  1  0.25000000  0.31283478  0.98472916  1.0
  Th  Th7  1  0.75000000  0.81287782  0.51482635  1.0
  Se  Se8  1  0.25000000  0.30013432  0.72522152  1.0
  Se  Se9  1  0.25000000  0.20245480  0.22408013  1.0
  Se  Se10  1  0.75000000  0.70451077  0.27238170  1.0
  Se  Se11  1  0.75000000  0.79273795  0.77387971  1.0
  Se  Se12  1  0.75000000  0.05669270  0.62107891  1.0
  Se  Se13  1  0.75000000  0.44945237  0.11836099  1.0
  Se  Se14  1  0.25000000  0.94393575  0.37922807  1.0
  Se  Se15  1  0.25000000  0.55802498  0.88633539  1.0
  Se  Se16  1  0.25000000  0.62673787  0.54754740  1.0
  Se  Se17  1  0.25000000  0.86627838  0.04473904  1.0
  Se  Se18  1  0.75000000  0.37498590  0.45290897  1.0
  Se  Se19  1  0.75000000  0.12508133  0.95144881  1.0