data_[K2Mn2Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Mn  1.5500  1.4000  0.6483
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.0778]
_cell_length_b [4.2616]
_cell_length_c [12.2915]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.8906]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KMnPd]
_chemical_formula_sum '[K2 Mn2 Pd2]'
_cell_volume [160.3713]
_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
[
  K  K0  2  0.3391  0.2500  0.1678  1
  Mn  Mn1  2  0.4725  0.2500  0.4293  1
  Pd  Pd2  2  0.0477  0.2500  0.6160  1
]