data_[Dy12Sc2Tl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [10.0072]
_cell_length_b [5.1883]
_cell_length_c [11.4165]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0810]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Dy6ScTl3]
_chemical_formula_sum '[Dy12 Sc2 Tl6]'
_cell_volume [574.9314]
_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  2  0.1117  0.7500  0.8885  1
  Dy  Dy1  2  0.1155  0.7500  0.1957  1
  Dy  Dy2  2  0.1816  0.2500  0.7019  1
  Dy  Dy3  2  0.2539  0.7500  0.5042  1
  Dy  Dy4  2  0.3423  0.2500  0.3167  1
  Dy  Dy5  2  0.4410  0.7500  0.0924  1
  Sc  Sc6  2  0.0395  0.2500  0.4015  1
  Tl  Tl7  2  0.2133  0.2500  0.0331  1
  Tl  Tl8  2  0.3839  0.7500  0.7961  1
  Tl  Tl9  2  0.4669  0.2500  0.6080  1
]