data_[La4Pr16Tm2]
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/m]
_cell_length_a [18.7355]
_cell_length_b [5.1949]
_cell_length_c [8.3676]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9730]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2Pr8Tm]
_chemical_formula_sum '[La4 Pr16 Tm2]'
_cell_volume [786.7614]
_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  0.2267  0.0000  0.6369  1.0
  Pr  Pr1  4  0.0449  0.0000  0.7304  1.0
  Pr  Pr2  4  0.0899  0.5000  0.4503  1.0
  Pr  Pr3  4  0.1347  0.0000  0.1779  1.0
  Pr  Pr4  4  0.1798  0.5000  0.9080  1.0
  Tm  Tm5  2  0.0000  0.5000  0.0000  1.0
]