data_[Ta4Pd8Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1601]
_cell_length_b [6.9689]
_cell_length_c [7.0141]
_cell_angle_alpha [88.1773]
_cell_angle_beta [82.3039]
_cell_angle_gamma [68.6199]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ta2Pd4Au]
_chemical_formula_sum '[Ta4 Pd8 Au2]'
_cell_volume [232.7131]
_cell_formula_units_Z [2]
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
[
  Ta  Ta0  1  0.2056  0.5879  0.7417  1
  Ta  Ta1  1  0.4651  0.1723  0.6006  1
  Ta  Ta2  1  0.6724  0.5919  0.0123  1
  Ta  Ta3  1  0.6844  0.7292  0.5656  1
  Pd  Pd4  1  0.0543  0.9432  0.5050  1
  Pd  Pd5  1  0.0552  0.3823  0.3969  1
  Pd  Pd6  1  0.0656  0.7110  0.1615  1
  Pd  Pd7  1  0.2775  0.9302  0.8659  1
  Pd  Pd8  1  0.3248  0.3152  0.9993  1
  Pd  Pd9  1  0.4881  0.5133  0.3726  1
  Pd  Pd10  1  0.7732  0.9348  0.8690  1
  Pd  Pd11  1  0.8531  0.3066  0.7558  1
  Au  Au12  1  0.4733  0.9587  0.2411  1
  Au  Au13  1  0.8574  0.1733  0.1626  1
]