# generated using pymatgen
data_Th3Pd12Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84533460
_cell_length_b   5.84533380
_cell_length_c   9.59876845
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999895
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Pd12Au
_chemical_formula_sum   'Th3 Pd12 Au1'
_cell_volume   284.03041255
_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
  Th  Th0  1  0.00000000  0.00000000  0.48919189  1.0
  Th  Th1  1  0.00000000  0.00000000  0.01080811  1.0
  Th  Th2  1  0.66666700  0.33333300  0.75000000  1.0
  Pd  Pd3  1  0.49801476  0.50198524  0.49662015  1.0
  Pd  Pd4  1  0.49801476  0.99602853  0.49662015  1.0
  Pd  Pd5  1  0.00397147  0.50198524  0.49662015  1.0
  Pd  Pd6  1  0.49801476  0.50198524  0.00337985  1.0
  Pd  Pd7  1  0.49801476  0.99602853  0.00337985  1.0
  Pd  Pd8  1  0.00397147  0.50198524  0.00337985  1.0
  Pd  Pd9  1  0.82530320  0.65060640  0.25000000  1.0
  Pd  Pd10  1  0.34939360  0.17469680  0.25000000  1.0
  Pd  Pd11  1  0.82530320  0.17469680  0.25000000  1.0
  Pd  Pd12  1  0.17300384  0.34600868  0.75000000  1.0
  Pd  Pd13  1  0.65399132  0.82699616  0.75000000  1.0
  Pd  Pd14  1  0.17300384  0.82699616  0.75000000  1.0
  Au  Au15  1  0.33333300  0.66666700  0.25000000  1.0