data_[Ca2Pm14Sm24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Pm  1.1300  1.8500  1.1100
  Sm  1.1700  1.8500  1.2290
]
_symmetry_space_group_name_H-M [Im-3m]
_cell_length_a [11.5561]
_cell_length_b [11.5561]
_cell_length_c [11.5561]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [229]
_chemical_formula_structural [CaPm7Sm12]
_chemical_formula_sum '[Ca2 Pm14 Sm24]'
_cell_volume [1543.2501]
_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
[
  Ca  Ca0  2  0.0000  0.0000  0.0000  1
  Pm  Pm1  8  0.2500  0.2500  0.2500  1
  Pm  Pm2  6  0.0000  0.0000  0.5000  1
  Sm  Sm3  24  0.0000  0.2542  0.2542  1
]