data_[Al1Tl2Sn1Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Tl  1.6200  1.9000  1.3325
  Sn  1.9600  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5192]
_cell_length_b [6.7834]
_cell_length_c [6.9976]
_cell_angle_alpha [61.9887]
_cell_angle_beta [65.3176]
_cell_angle_gamma [66.5201]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [AlTl2SnAu6]
_chemical_formula_sum '[Al1 Tl2 Sn1 Au6]'
_cell_volume [240.2193]
_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
[
  Al  Al0  1  0.5000  0.5000  0.5000  1.0
  Tl  Tl1  2  0.0888  0.2843  0.3486  1.0
  Sn  Sn2  1  0.0000  0.0000  0.0000  1.0
  Au  Au3  2  0.3141  0.8115  0.6778  1.0
  Au  Au4  2  0.3628  0.6289  0.1520  1.0
  Au  Au5  2  0.4424  0.0983  0.7913  1.0
]