data_[La6Pr2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.1019]
_cell_length_b [6.3042]
_cell_length_c [10.8608]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.9225]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [La3PrO6]
_chemical_formula_sum '[La6 Pr2 O12]'
_cell_volume [346.6791]
_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  4  0.2698  0.5414  0.2587  1.0
  La  La1  2  0.5000  0.0000  0.5000  1.0
  Pr  Pr2  2  0.0000  0.0000  0.0000  1.0
  O  O3  4  0.0955  0.5875  0.7459  1.0
  O  O4  4  0.2762  0.1881  0.5903  1.0
  O  O5  4  0.3930  0.6772  0.5670  1.0
]