data_CuMo2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.67
_cell_length_b   4.21
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   94.26
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuMo2Pd
_chemical_formula_sum   'Cu1 Mo2 Pd1'
_cell_volume   59.3
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Mo  Mo1  1  0.17  0.1  0.24  1.0
  Mo  Mo2  1  0.11  0.1  0.04  1.0
  Pd  Pd3  1  0.8  0.0  0.64  1.0

data_CuMo2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.67
_cell_length_b   4.21
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   94.26
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuMo2Pd
_chemical_formula_sum   'Cu1 Mo2 Pd1'
_cell_volume   59.3
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Mo  Mo1  1  0.11  0.1  0.04  1.0
  Mo  Mo2  1  0.17  0.1  0.24  1.0
  Pd  Pd3  1  0.8  0.0  0.64  1.0

Cu Mo Mo Pd
Cu Mo Mo Pd 0 2 o o o 0 3 - o - 1 2 o o o 1 3 - o o 2 3 - o - 