# generated using pymatgen
data_Pr2NdThSe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.51400757
_cell_length_b   4.14914702
_cell_length_c   11.29555035
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr2NdThSe6
_chemical_formula_sum   'Pr4 Nd2 Th2 Se12'
_cell_volume   539.62582985
_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  0.51521845  0.75000000  0.81375446  1.0
  Pr  Pr1  1  0.01521845  0.75000000  0.68624554  1.0
  Pr  Pr2  1  0.30601587  0.25000000  0.50640425  1.0
  Pr  Pr3  1  0.80601587  0.25000000  0.99359575  1.0
  Nd  Nd4  1  0.48621788  0.25000000  0.18646412  1.0
  Nd  Nd5  1  0.98621788  0.25000000  0.31353588  1.0
  Th  Th6  1  0.69167578  0.75000000  0.50039160  1.0
  Th  Th7  1  0.19167578  0.75000000  0.99960840  1.0
  Se  Se8  1  0.54961315  0.25000000  0.62409985  1.0
  Se  Se9  1  0.04961315  0.25000000  0.87590015  1.0
  Se  Se10  1  0.45544501  0.75000000  0.37473686  1.0
  Se  Se11  1  0.95544501  0.75000000  0.12526314  1.0
  Se  Se12  1  0.62143714  0.75000000  0.05623890  1.0
  Se  Se13  1  0.12143714  0.75000000  0.44376110  1.0
  Se  Se14  1  0.37705447  0.25000000  0.94668552  1.0
  Se  Se15  1  0.87705447  0.25000000  0.55331448  1.0
  Se  Se16  1  0.72344541  0.25000000  0.30554385  1.0
  Se  Se17  1  0.22344541  0.25000000  0.19445615  1.0
  Se  Se18  1  0.27387784  0.75000000  0.70528642  1.0
  Se  Se19  1  0.77387784  0.75000000  0.79471358  1.0