data_[Dy3Ho12Tl3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Ho  1.2300  1.7500  1.0410
  Tl  1.6200  1.9000  1.3325
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.1733]
_cell_length_b [8.1733]
_cell_length_c [20.0982]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [DyHo4TlS8]
_chemical_formula_sum '[Dy3 Ho12 Tl3 S24]'
_cell_volume [1162.7367]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0042  1.0
  Ho  Ho1  9  0.1721  0.3442  0.8320  1.0
  Ho  Ho2  3  0.0000  0.0000  0.6252  1.0
  Tl  Tl3  3  0.0000  0.0000  0.3743  1.0
  S  S4  9  0.0436  0.5218  0.7560  1.0
  S  S5  9  0.1763  0.3526  0.5807  1.0
  S  S6  3  0.0000  0.0000  0.2330  1.0
  S  S7  3  0.0000  0.0000  0.7574  1.0
]