data_[Pm6Zn10Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Zn  1.6500  1.3500  0.8800
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [4.5648]
_cell_length_b [13.4163]
_cell_length_c [9.1924]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Pm3Zn5Au6]
_chemical_formula_sum '[Pm6 Zn10 Au12]'
_cell_volume [562.9634]
_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
[
  Pm  Pm0  4  0.0000  0.2982  0.7488  1
  Pm  Pm1  2  0.0000  0.0000  0.7573  1
  Zn  Zn2  4  0.0000  0.1343  0.4684  1
  Zn  Zn3  4  0.0000  0.3320  0.0996  1
  Zn  Zn4  2  0.0000  0.0000  0.2553  1
  Au  Au5  4  0.0000  0.1349  0.0377  1
  Au  Au6  4  0.0000  0.3367  0.3798  1
  Au  Au7  2  0.0000  0.5000  0.5758  1
  Au  Au8  2  0.0000  0.5000  0.9424  1
]