data_[Tb4Ho4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ho  1.2300  1.7500  1.0410
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.9429]
_cell_length_b [5.6188]
_cell_length_c [10.2602]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.0491]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TbHoPd3]
_chemical_formula_sum '[Tb4 Ho4 Pd12]'
_cell_volume [411.3968]
_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  4  0.1444  0.2459  0.0393  1.0
  Ho  Ho1  4  0.3773  0.6713  0.3130  1.0
  Pd  Pd2  4  0.0054  0.0355  0.7517  1.0
  Pd  Pd3  4  0.2474  0.7476  0.5172  1.0
  Pd  Pd4  4  0.3636  0.1707  0.3637  1.0
]