data_KPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03
_cell_length_b   4.6
_cell_length_c   9.95
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPd2
_chemical_formula_sum   'K4 Pd8'
_cell_volume   276.11
_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
  K  K0  1  0.61  0.15  0.96  1.0
  K  K1  1  0.4  0.45  0.98  1.0
  K  K2  1  0.63  0.15  0.97  1.0
  K  K3  1  0.42  0.45  0.99  1.0
  Pd  Pd4  1  0.07  0.15  0.99  1.0
  Pd  Pd5  1  0.51  0.15  0.7  1.0
  Pd  Pd6  1  0.51  0.45  0.73  1.0
  Pd  Pd7  1  0.94  0.45  0.97  1.0
  Pd  Pd8  1  0.09  0.15  0.98  1.0
  Pd  Pd9  1  0.53  0.15  0.22  1.0
  Pd  Pd10  1  0.53  0.45  0.25  1.0
  Pd  Pd11  1  0.96  0.45  0.96  1.0

data_KPd2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.6
_cell_length_b   6.03
_cell_length_c   9.95
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   KPd2
_chemical_formula_sum   'K4 Pd8'
_cell_volume   276.11
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  0.35  0.1  0.98  1.0
  K  K1  2  0.35  0.11  0.99  1.0
  Pd  Pd2  2  0.35  0.01  0.25  1.0
  Pd  Pd3  2  0.35  0.56  0.02  1.0
  Pd  Pd4  2  0.35  0.57  0.01  1.0
  Pd  Pd5  2  0.35  0.99  0.73  1.0

K K K K Pd Pd Pd Pd Pd Pd Pd Pd
K K K K Pd Pd Pd Pd Pd Pd Pd Pd 0 2 o o o 1 3 o o o 4 8 o o o 5 6 o o o 7 11 o o o 9 10 o o o 