data_NaTaAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23
_cell_length_b   5.23
_cell_length_c   5.23
_cell_angle_alpha   134.21
_cell_angle_beta   134.21
_cell_angle_gamma   66.75
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTaAu2
_chemical_formula_sum   'Na1 Ta1 Au2'
_cell_volume   72.51
_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
  Na  Na2  1  0.0  0.0  0.0  1.0
  Ta  Ta3  1  0.04  0.0  0.19  1.0
  Au  Au0  1  0.0  0.0  0.37  1.0
  Au  Au1  1  0.0  0.04  0.19  1.0

data_NaTaAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.07
_cell_length_b   4.07
_cell_length_c   5.23
_cell_angle_alpha   112.89
_cell_angle_beta   112.89
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTaAu2
_chemical_formula_sum   'Na1 Ta1 Au2'
_cell_volume   72.51
_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
  Na  Na0  1  0.0  0.0  0.0  1.0
  Ta  Ta1  1  0.19  0.15  0.15  1.0
  Au  Au2  1  0.15  0.19  0.15  1.0
  Au  Au3  1  0.37  0.37  0.37  1.0

Na Ta Au Au