data_[Mn4Cd4O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Cd  1.6900  1.5500  1.0900
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pna2_1]
_cell_length_a [6.1790]
_cell_length_b [7.1323]
_cell_length_c [5.6473]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [33]
_chemical_formula_structural [MnCdO2]
_chemical_formula_sum '[Mn4 Cd4 O8]'
_cell_volume [248.8832]
_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
[
  Mn  Mn0  4  0.0814  0.8740  0.0042  1.0
  Cd  Cd1  4  0.0867  0.3757  0.0057  1.0
  O  O2  4  0.0715  0.8866  0.6337  1.0
  O  O3  4  0.0933  0.3639  0.6062  1.0
]