data_[Pm4Dy4Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Dy  1.2200  1.7500  1.1310
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.0810]
_cell_length_b [5.3019]
_cell_length_c [6.1998]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1013]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PmDyAu3]
_chemical_formula_sum '[Pm4 Dy4 Au12]'
_cell_volume [468.4266]
_cell_formula_units_Z [4]
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  0.0951  0.5000  0.9017  1
  Dy  Dy1  4  0.1850  0.0000  0.6087  1
  Au  Au2  4  0.0001  0.0000  0.7560  1
  Au  Au3  4  0.1177  0.5000  0.4123  1
  Au  Au4  4  0.2112  0.0000  0.1214  1
]