data_AlCo2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.9
_cell_length_b   4.9
_cell_length_c   2.65
_cell_angle_alpha   99.95
_cell_angle_beta   99.95
_cell_angle_gamma   118.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCo2Pd
_chemical_formula_sum   'Al1 Co2 Pd1'
_cell_volume   52.25
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.79  0.11  0.25  1.0
  Co  Co2  1  0.79  0.89  0.25  1.0
  Pd  Pd3  1  0.49  0.0  0.0  1.0

data_AlCo2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.65
_cell_length_b   4.77
_cell_length_c   4.9
_cell_angle_alpha   115.68
_cell_angle_beta   99.95
_cell_angle_gamma   101.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCo2Pd
_chemical_formula_sum   'Al1 Co2 Pd1'
_cell_volume   52.25
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.14  0.89  0.68  1.0
  Co  Co2  1  0.35  0.11  0.9  1.0
  Pd  Pd3  1  0.0  0.0  0.49  1.0

Al Co Co Pd