data_CoPd2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.73
_cell_length_b   3.95
_cell_length_c   5.33
_cell_angle_alpha   90.0
_cell_angle_beta   91.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoPd2W
_chemical_formula_sum   'Co1 Pd2 W1'
_cell_volume   57.63
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.35  0.98  0.31  1.0
  Pd  Pd2  1  0.3  0.98  0.02  1.0
  W  W3  1  0.95  0.0  0.67  1.0

data_CoPd2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   3.95
_cell_length_c   5.33
_cell_angle_alpha   90.0
_cell_angle_beta   91.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoPd2W
_chemical_formula_sum   'Co1 Pd2 W1'
_cell_volume   57.63
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.3  0.98  0.02  1.0
  Pd  Pd2  1  0.35  0.98  0.31  1.0
  W  W3  1  0.95  0.0  0.67  1.0

Co Pd Pd W
Co Pd Pd W 0 2 o - o 0 1 o - o 0 3 - o - 1 2 o o o 1 3 - + o 2 3 - + - 