# generated using pymatgen
data_Nd(ThPd4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91555526
_cell_length_b   5.91554889
_cell_length_c   9.71305549
_cell_angle_alpha   90.00003240
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00003565
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(ThPd4)3
_chemical_formula_sum   'Nd1 Th3 Pd12'
_cell_volume   294.35872243
_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  0.00000000  0.00000000  0.00000000  1.0
  Th  Th1  1  0.33333036  0.66665873  0.24657633  1.0
  Th  Th2  1  0.00000000  0.00000000  0.50000000  1.0
  Th  Th3  1  0.66666964  0.33334027  0.75342367  1.0
  Pd  Pd4  1  0.50000000  0.00000000  0.00000000  1.0
  Pd  Pd5  1  0.99999900  0.50000100  0.00000000  1.0
  Pd  Pd6  1  0.50000100  0.50000100  0.00000000  1.0
  Pd  Pd7  1  0.35200667  0.17599463  0.25207367  1.0
  Pd  Pd8  1  0.82398896  0.17599463  0.25207367  1.0
  Pd  Pd9  1  0.82399101  0.64798202  0.25207345  1.0
  Pd  Pd10  1  0.50000000  0.00000000  0.50000000  1.0
  Pd  Pd11  1  0.99999900  0.50000100  0.50000000  1.0
  Pd  Pd12  1  0.50000100  0.50000100  0.50000000  1.0
  Pd  Pd13  1  0.17600899  0.35201898  0.74792655  1.0
  Pd  Pd14  1  0.17601304  0.82400637  0.74792633  1.0
  Pd  Pd15  1  0.64799333  0.82400637  0.74792633  1.0