data_[Pr12Sn4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Sn  1.9600  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [9.4328]
_cell_length_b [11.7399]
_cell_length_c [5.8665]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Pr3SnO6]
_chemical_formula_sum '[Pr12 Sn4 O24]'
_cell_volume [649.6616]
_cell_formula_units_Z [4]
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  8  0.1973  0.1076  0.9780  1.0
  Pr  Pr1  4  0.0000  0.3989  0.9250  1.0
  Sn  Sn2  4  0.0000  0.1674  0.4893  1.0
  O  O3  8  0.1542  0.2567  0.6710  1.0
  O  O4  8  0.1600  0.4861  0.2009  1.0
  O  O5  4  0.0000  0.0186  0.7282  1.0
  O  O6  4  0.0000  0.2259  0.1432  1.0
]