data_[Sr12Mn6Pd6O36]
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
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.6239]
_cell_length_b [5.6239]
_cell_length_c [28.5117]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Sr2MnPdO6]
_chemical_formula_sum '[Sr12 Mn6 Pd6 O36]'
_cell_volume [780.9580]
_cell_formula_units_Z [6]
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  6  0.0000  0.0000  0.1195  1.0
  Sr  Sr1  6  0.0000  0.0000  0.2879  1.0
  Mn  Mn2  3  -0.0000  -0.0000  0.5000  1.0
  Mn  Mn3  3  0.0000  0.0000  0.0000  1.0
  Pd  Pd4  6  0.0000  0.0000  0.4100  1.0
  O  O5  18  0.0226  0.5113  0.1241  1.0
  O  O6  18  0.0227  0.5114  0.7081  1.0
]