data_[La6Pr16Sm4]
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
  Sm  1.1700  1.8500  1.2290
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4233]
_cell_length_b [8.3201]
_cell_length_c [17.7680]
_cell_angle_alpha [89.9943]
_cell_angle_beta [86.6200]
_cell_angle_gamma [82.5016]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [La3(Pr4Sm)2]
_chemical_formula_sum '[La6 Pr16 Sm4]'
_cell_volume [939.7740]
_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  0.3859  0.9619  0.7305  1
  La  La1  2  0.3871  0.4614  0.2309  1
  La  La2  1  0.0000  0.0000  0.0000  1
  La  La3  1  0.0000  0.5000  0.5000  1
  Pr  Pr4  2  0.0757  0.1938  0.3469  1
  Pr  Pr5  2  0.0760  0.6922  0.8465  1
  Pr  Pr6  2  0.1553  0.8836  0.1921  1
  Pr  Pr7  2  0.1555  0.3850  0.6924  1
  Pr  Pr8  2  0.2305  0.5764  0.0382  1
  Pr  Pr9  2  0.2315  0.0760  0.5380  1
  Pr  Pr10  2  0.3074  0.7676  0.3853  1
  Pr  Pr11  2  0.4621  0.1535  0.0764  1
  Sm  Sm12  2  0.3073  0.2694  0.8847  1
  Sm  Sm13  2  0.4617  0.6538  0.5763  1
]