data_Zn2CuPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   4.97
_cell_angle_alpha   142.32
_cell_angle_beta   131.41
_cell_angle_gamma   63.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2CuPd
_chemical_formula_sum   'Zn2 Cu1 Pd1'
_cell_volume   55.64
_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
  Zn  Zn2  1  0.0  0.0  0.45  1.0
  Zn  Zn3  1  0.0  0.05  0.08  1.0
  Cu  Cu0  1  0.0  0.0  0.3  1.0
  Pd  Pd1  1  0.61  0.0  0.12  1.0

data_Zn2CuPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.21
_cell_length_b   4.09
_cell_length_c   4.97
_cell_angle_alpha   114.29
_cell_angle_beta   108.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2CuPd
_chemical_formula_sum   'Zn2 Cu1 Pd1'
_cell_volume   55.64
_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
  Zn  Zn0  1  0.55  0.55  0.55  1.0
  Zn  Zn1  1  0.92  0.96  0.96  1.0
  Cu  Cu2  1  0.7  0.7  0.7  1.0
  Pd  Pd3  1  0.49  0.88  0.49  1.0

Zn Zn Cu Pd