data_[Pm2Al2Au5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Al  1.6100  1.2500  0.6750
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.6675]
_cell_length_b [4.6675]
_cell_length_c [8.7220]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Pm2Al2Au5]
_chemical_formula_sum '[Pm2 Al2 Au5]'
_cell_volume [190.0110]
_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
[
  Pm  Pm0  1  0.0000  0.0000  0.0000  1
  Pm  Pm1  1  0.0000  0.0000  0.5000  1
  Al  Al2  2  0.5000  0.5000  0.1489  1
  Au  Au3  4  0.0000  0.5000  0.2678  1
  Au  Au4  1  0.5000  0.5000  0.5000  1
]