data_[La2Pm4Pr1Th1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pm  1.1300  1.8500  1.1100
  Pr  1.1300  1.8500  1.0600
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.3778]
_cell_length_b [3.6743]
_cell_length_c [12.1050]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0780]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [La2Pm4PrTh]
_chemical_formula_sum '[La2 Pm4 Pr1 Th1]'
_cell_volume [279.2938]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1
  La  La1  1  0.0000  0.5000  0.5000  1
  Pm  Pm2  2  0.2549  0.0000  0.7479  1
  Pm  Pm3  2  0.2570  0.5000  0.2575  1
  Pr  Pr4  1  0.5000  0.5000  0.0000  1
  Th  Th5  1  0.5000  0.0000  0.5000  1
]