data_[Tm4Al2Ga24]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P4/nbm]
_cell_length_a [5.8553]
_cell_length_b [5.8553]
_cell_length_c [16.9461]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [125]
_chemical_formula_structural [Tm2AlGa12]
_chemical_formula_sum '[Tm4 Al2 Ga24]'
_cell_volume [580.9891]
_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
[
  Tm  Tm0  4  0.0000  0.5000  0.2746  1
  Al  Al1  2  0.0000  0.5000  0.0000  1
  Ga  Ga2  8  0.1743  0.3257  0.4336  1
  Ga  Ga3  8  0.2483  0.2517  0.8949  1
  Ga  Ga4  4  0.0000  0.0000  0.2024  1
  Ga  Ga5  4  0.0000  0.0000  0.3469  1
]