data_[La12Pm4Sm2Sc2]
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
  Sm  1.1700  1.8500  1.2290
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5008]
_cell_length_b [6.8938]
_cell_length_c [9.2938]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.5840]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6Pm2SmSc]
_chemical_formula_sum '[La12 Pm4 Sm2 Sc2]'
_cell_volume [698.4318]
_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  8  0.2017  0.2336  0.8111  1
  La  La1  4  0.1277  0.5000  0.4181  1
  Pm  Pm2  4  0.0702  0.0000  0.1694  1
  Sm  Sm3  2  0.0000  0.0000  0.5000  1
  Sc  Sc4  2  0.0000  0.5000  0.0000  1
]