data_[Nd24Ho4Tl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.1795]
_cell_length_b [11.8577]
_cell_length_c [5.9935]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.0579]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nd6HoTl2]
_chemical_formula_sum '[Nd24 Ho4 Tl8]'
_cell_volume [1135.5165]
_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
[
  Nd  Nd0  8  0.0578  0.3870  0.5338  1.0
  Nd  Nd1  8  0.1139  0.1115  0.8025  1.0
  Nd  Nd2  8  0.2376  0.1242  0.3321  1.0
  Ho  Ho3  4  0.0000  0.1445  0.2500  1.0
  Tl  Tl4  8  0.1556  0.3624  0.0990  1.0
]