data_[Pr2Mn14O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Mn  1.5500  1.4000  0.6483
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7010]
_cell_length_b [7.5527]
_cell_length_c [7.5761]
_cell_angle_alpha [90.0000]
_cell_angle_beta [134.7001]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PrMn7O12]
_chemical_formula_sum '[Pr2 Mn14 O24]'
_cell_volume [435.2287]
_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
[
  Pr  Pr0  2  0.0000  0.0000  0.0000  1.0
  Mn  Mn1  4  0.2500  0.2500  0.0000  1.0
  Mn  Mn2  4  0.2500  0.2500  0.5000  1.0
  Mn  Mn3  2  0.0000  0.0000  0.5000  1.0
  Mn  Mn4  2  0.0000  0.5000  0.0000  1.0
  Mn  Mn5  2  0.0000  0.5000  0.5000  1.0
  O  O6  8  0.0076  0.3073  0.8336  1.0
  O  O7  8  0.1922  0.6748  0.6879  1.0
  O  O8  4  0.1713  0.0000  0.8667  1.0
  O  O9  4  0.1777  0.0000  0.4868  1.0
]