data_[Tb24Pm4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pm  1.1300  1.8500  1.1100
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [11.5237]
_cell_length_b [13.2340]
_cell_length_c [7.2400]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Tb6PmPd3]
_chemical_formula_sum '[Tb24 Pm4 Pd12]'
_cell_volume [1104.1325]
_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
[
  Tb  Tb0  8  0.1701  0.4600  0.3316  1
  Tb  Tb1  8  0.2266  0.1928  0.1783  1
  Tb  Tb2  4  0.0000  0.0333  0.8389  1
  Tb  Tb3  4  0.0000  0.2321  0.4803  1
  Pm  Pm4  4  0.0000  0.3173  0.9622  1
  Pd  Pd5  8  0.1865  0.1006  0.5453  1
  Pd  Pd6  4  0.0000  0.4276  0.6228  1
]