data_[La2Pr16Tm4]
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 [9.2420]
_cell_length_b [16.8236]
_cell_length_c [6.0931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.1632]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La(Pr4Tm)2]
_chemical_formula_sum '[La2 Pr16 Tm4]'
_cell_volume [783.9046]
_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  2  0.0000  0.0000  0.5000  1
  Pr  Pr1  8  0.2196  0.8791  0.1845  1
  Pr  Pr2  4  0.0000  0.2057  0.5000  1
  Pr  Pr3  4  0.0773  0.5000  0.2959  1
  Tm  Tm4  4  0.0000  0.3108  0.0000  1
]