data_[Dy12Tl4Ni2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Tl  1.6200  1.9000  1.3325
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1736]
_cell_length_b [7.1034]
_cell_length_c [12.4265]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.1639]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Dy6Tl2Ni]
_chemical_formula_sum '[Dy12 Tl4 Ni2]'
_cell_volume [517.6591]
_cell_formula_units_Z [2]
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
[
  Dy  Dy0  4  0.1794  0.0038  0.2481  1.0
  Dy  Dy1  4  0.2460  0.7257  0.0324  1.0
  Dy  Dy2  4  0.3147  0.2185  0.0345  1.0
  Tl  Tl3  4  0.2556  0.0300  0.7489  1.0
  Ni  Ni4  2  0.5000  0.0000  0.5000  1.0
]