data_[Tb3Ho5]
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
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.6321]
_cell_length_b [5.6266]
_cell_length_c [12.5694]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Tb3Ho5]
_chemical_formula_sum '[Tb3 Ho5]'
_cell_volume [256.8764]
_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
[
  Tb  Tb0  1  0.0000  0.5000  0.7923  1.0
  Tb  Tb1  1  0.5000  0.0000  0.7092  1.0
  Tb  Tb2  1  0.5000  0.5000  0.5403  1.0
  Ho  Ho3  1  0.0000  0.0000  0.4570  1.0
  Ho  Ho4  1  0.0000  0.0000  0.9598  1.0
  Ho  Ho5  1  0.0000  0.5000  0.2907  1.0
  Ho  Ho6  1  0.5000  0.0000  0.2083  1.0
  Ho  Ho7  1  0.5000  0.5000  0.0424  1.0
]