data_[Sr8Mn8O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Mn  1.5500  1.4000  0.6483
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.5979]
_cell_length_b [9.9483]
_cell_length_c [5.1305]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.9707]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SrMnO3]
_chemical_formula_sum '[Sr8 Mn8 O24]'
_cell_volume [540.1866]
_cell_formula_units_Z [8]
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  8  0.2050  0.3910  0.2979  1.0
  Mn  Mn1  4  0.0000  0.0739  0.2500  1.0
  Mn  Mn2  4  0.0000  0.2419  0.7500  1.0
  O  O3  8  0.0941  0.2036  0.4436  1.0
  O  O4  8  0.0971  0.0702  0.9364  1.0
  O  O5  8  0.1244  0.3647  0.8448  1.0
]