data_[La4Pr20Tm12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [18.7715]
_cell_length_b [6.6046]
_cell_length_c [11.3820]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.3380]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaPr5Tm3]
_chemical_formula_sum '[La4 Pr20 Tm12]'
_cell_volume [1285.7145]
_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
[
  La  La0  4  0.0000  0.1440  0.2500  1
  Pr  Pr1  8  0.1680  0.3058  0.2096  1
  Pr  Pr2  8  0.1686  0.1684  0.8623  1
  Pr  Pr3  4  0.0000  0.3974  0.7500  1
  Tm  Tm4  8  0.1613  0.2997  0.5136  1
  Tm  Tm5  4  0.0000  0.0000  0.0000  1
]