data_[La12Tm2Al4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tm  1.2500  1.7500  1.0950
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.2131]
_cell_length_b [3.8156]
_cell_length_c [11.9838]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.1566]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6TmAl2]
_chemical_formula_sum '[La12 Tm2 Al4]'
_cell_volume [574.0911]
_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
[
  La  La0  4  0.0332  0.0000  0.3282  1
  La  La1  4  0.1768  0.5000  0.8779  1
  La  La2  4  0.1937  0.5000  0.6015  1
  Tm  Tm3  2  0.0000  0.0000  0.0000  1
  Al  Al4  4  0.1467  0.5000  0.1815  1
]