data_[Tb4Ho4Ni4]
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
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8168]
_cell_length_b [3.3945]
_cell_length_c [6.8588]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.5293]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TbHoNi]
_chemical_formula_sum '[Tb4 Ho4 Ni4]'
_cell_volume [287.5124]
_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  0.1305  0.0000  0.5654  1
  Ho  Ho1  4  0.1314  0.0000  0.0659  1
  Ni  Ni2  4  0.0001  0.5000  0.2409  1
]