# generated using pymatgen
data_Ba2Tl3Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25513000
_cell_length_b   6.87185147
_cell_length_c   6.59410725
_cell_angle_alpha   94.06658436
_cell_angle_beta   113.48267058
_cell_angle_gamma   67.51966080
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Tl3Au
_chemical_formula_sum   'Ba2 Tl3 Au1'
_cell_volume   200.87703073
_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  0.74909100  0.29207800  0.79026000  1.0
  Ba  Ba1  1  0.25402700  0.70416900  0.21222400  1.0
  Tl  Tl2  1  0.95519900  0.69784100  0.60823900  1.0
  Tl  Tl3  1  0.56113700  0.11759700  0.23987000  1.0
  Tl  Tl4  1  0.44197300  0.89480300  0.77874900  1.0
  Au  Au5  1  0.03857300  0.29351200  0.37065800  1.0