data_[Y9Tm6Cd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Tm  1.2500  1.7500  1.0950
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.3530]
_cell_length_b [5.3530]
_cell_length_c [23.7030]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Y3(TmCd)2]
_chemical_formula_sum '[Y9 Tm6 Cd6]'
_cell_volume [588.2004]
_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
[
  Y  Y0  6  0.0000  0.0000  0.1571  1.0
  Y  Y1  3  0.0000  0.0000  0.0000  1.0
  Tm  Tm2  6  0.0000  0.0000  0.4261  1.0
  Cd  Cd3  6  0.0000  0.0000  0.2886  1.0
]