data_[Na6Mn3Pd3Br18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Mn  1.5500  1.4000  0.6483
  Pd  2.2000  1.4000  0.8462
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [7.1192]
_cell_length_b [7.1192]
_cell_length_c [18.4150]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [Na2MnPdBr6]
_chemical_formula_sum '[Na6 Mn3 Pd3 Br18]'
_cell_volume [808.2937]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.0259  1
  Na  Na1  3  0.0000  0.0000  0.5275  1
  Mn  Mn2  3  0.0000  0.0000  0.3241  1
  Pd  Pd3  3  0.0000  0.0000  0.8242  1
  Br  Br4  9  0.0085  0.6103  0.0759  1
  Br  Br5  9  0.0610  0.3342  0.9111  1
]