# generated using pymatgen
data_ThPd2Pt2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37145364
_cell_length_b   5.36942198
_cell_length_c   5.36942224
_cell_angle_alpha   59.79162989
_cell_angle_beta   59.98748829
_cell_angle_gamma   59.98749225
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThPd2Pt2Au
_chemical_formula_sum   'Th1 Pd2 Pt2 Au1'
_cell_volume   109.31039478
_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  0.00174660  0.99825340  0.99825340  1.0
  Pd  Pd1  1  0.62373781  0.62459592  0.12792646  1.0
  Pd  Pd2  1  0.62373781  0.12792646  0.62459592  1.0
  Pt  Pt3  1  0.12587958  0.62536464  0.62536464  1.0
  Pt  Pt4  1  0.62339114  0.62536464  0.62536464  1.0
  Au  Au5  1  0.25150606  0.24849394  0.24849394  1.0