# generated using pymatgen
data_BaTh(SnAu)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73144740
_cell_length_b   4.73144660
_cell_length_c   8.93973288
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000562
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTh(SnAu)2
_chemical_formula_sum   'Ba1 Th1 Sn2 Au2'
_cell_volume   173.31777656
_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
  Ba  Ba0  1  0.00000000  0.00000000  0.50000000  1.0
  Th  Th1  1  0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn2  1  0.33333300  0.66666700  0.76831633  1.0
  Sn  Sn3  1  0.66666700  0.33333300  0.23168367  1.0
  Au  Au4  1  0.33333300  0.66666700  0.18999257  1.0
  Au  Au5  1  0.66666700  0.33333300  0.81000743  1.0