data_[Tm24Al4Zn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.5061]
_cell_length_b [9.7309]
_cell_length_c [9.8703]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Tm6AlZn2]
_chemical_formula_sum '[Tm24 Al4 Zn8]'
_cell_volume [913.0274]
_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
[
  Tm  Tm0  8  0.0000  0.2805  0.3201  1
  Tm  Tm1  8  0.1808  0.2671  0.0000  1
  Tm  Tm2  8  0.2018  0.0000  0.2441  1
  Al  Al3  2  0.0000  0.0000  0.0000  1
  Al  Al4  2  0.0000  0.0000  0.5000  1
  Zn  Zn5  4  0.0000  0.5000  0.1266  1
  Zn  Zn6  4  0.1375  0.5000  0.5000  1
]