# generated using pymatgen
data_SmTlAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03994206
_cell_length_b   5.03994426
_cell_length_c   5.03993395
_cell_angle_alpha   59.99991312
_cell_angle_beta   59.99997587
_cell_angle_gamma   60.00001448
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTlAu2
_chemical_formula_sum   'Sm1 Tl1 Au2'
_cell_volume   90.52338960
_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
  Sm  Sm0  1  0.25000000  0.25000000  0.25000000  1.0
  Tl  Tl1  1  0.75000000  0.75000000  0.75000000  1.0
  Au  Au2  1  0.50000000  0.50000000  0.50000000  1.0
  Au  Au3  1  0.00000000  -0.00000000  0.00000000  1.0