data_[Pm1Pr4Nd2Th1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.3748]
_cell_length_b [3.6754]
_cell_length_c [12.2321]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0110]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [PmPr4Nd2Th]
_chemical_formula_sum '[Pm1 Pr4 Nd2 Th1]'
_cell_volume [282.2351]
_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
[
  Pr  Pr0  2  0.2530  0.0000  0.7483  1
  Pr  Pr1  2  0.2571  0.5000  0.2549  1
  Pm  Pm2  1  0.5000  0.5000  0.0000  1
  Nd  Nd3  1  0.0000  0.0000  0.0000  1
  Nd  Nd4  1  0.0000  0.5000  0.5000  1
  Th  Th5  1  0.5000  0.0000  0.5000  1
]