data_[Ca2Mn2Cd2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  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 [P2_1/m]
_cell_length_a [5.7486]
_cell_length_b [3.2902]
_cell_length_c [8.5545]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.1767]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CaMnCdO3]
_chemical_formula_sum '[Ca2 Mn2 Cd2 O6]'
_cell_volume [158.7304]
_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
[
  Ca  Ca0  2  0.3469  0.2500  0.3081  1.0
  Mn  Mn1  2  0.1413  0.2500  0.6397  1.0
  Cd  Cd2  2  0.2362  0.7500  0.9506  1.0
  O  O3  2  0.0469  0.7500  0.1708  1.0
  O  O4  2  0.2455  0.7500  0.5088  1.0
  O  O5  2  0.4549  0.2500  0.8247  1.0
]