data_KTa2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.26
_cell_length_b   11.26
_cell_length_c   11.26
_cell_angle_alpha   15.01
_cell_angle_beta   15.01
_cell_angle_gamma   15.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTa2Pd
_chemical_formula_sum   'K1 Ta2 Pd1'
_cell_volume   83.47
_cell_formula_units_Z   1
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  0.0  0.0  0.0  1.0
  Ta  Ta2  1  0.0  0.0  0.56  1.0
  Ta  Ta3  1  0.0  0.0  0.84  1.0
  Pd  Pd1  1  0.0  0.0  0.7  1.0

data_KTa2Pd
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.1
_cell_length_b   2.94
_cell_length_c   11.26
_cell_angle_alpha   90.0
_cell_angle_beta   98.68
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   KTa2Pd
_chemical_formula_sum   'K2 Ta4 Pd2'
_cell_volume   166.94
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.0  0.0  0.0  1.0
  Ta  Ta1  2  -0.0  0.0  0.44  1.0
  Ta  Ta2  2  -0.0  0.0  0.16  1.0
  Pd  Pd3  2  -0.0  0.0  0.3  1.0

K Ta Ta Pd
K Ta Ta Pd 0 2 o o - 1 3 o o o 2 3 o o o 