data_[Sr2Pr10Sm12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Pr  1.1300  1.8500  1.0600
  Sm  1.1700  1.8500  1.2290
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2710]
_cell_length_b [11.1380]
_cell_length_c [6.4200]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.1024]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SrPr5Sm6]
_chemical_formula_sum '[Sr2 Pr10 Sm12]'
_cell_volume [863.8391]
_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
[
  Sr  Sr0  2  0.0000  0.0000  0.0000  1
  Pr  Pr1  4  0.0000  0.1727  0.5000  1
  Pr  Pr2  4  0.0000  0.3392  0.0000  1
  Pr  Pr3  2  0.0000  0.5000  0.5000  1
  Sm  Sm4  8  0.2446  0.3293  0.7463  1
  Sm  Sm5  4  0.2468  0.5000  0.2595  1
]