data_AgPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.54
_cell_length_b   7.54
_cell_length_c   4.67
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   158.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgPd2
_chemical_formula_sum   'Ag2 Pd4'
_cell_volume   97.23
_cell_formula_units_Z   2
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
  Ag  Ag0  1  0.41  0.76  0.17  1.0
  Ag  Ag1  1  0.41  0.24  0.5  1.0
  Pd  Pd2  1  0.41  0.83  0.17  1.0
  Pd  Pd3  1  0.41  0.12  0.5  1.0
  Pd  Pd4  1  0.41  0.88  0.17  1.0
  Pd  Pd5  1  0.41  0.17  0.5  1.0

data_AgPd2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   2.81
_cell_length_b   4.67
_cell_length_c   7.54
_cell_angle_alpha   90.0
_cell_angle_beta   100.74
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   AgPd2
_chemical_formula_sum   'Ag2 Pd4'
_cell_volume   97.23
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Ag  Ag0  2  0.24  0.33  0.74  1.0
  Pd  Pd1  2  0.12  0.33  0.62  1.0
  Pd  Pd2  2  0.17  0.33  0.67  1.0

Ag Ag Pd Pd Pd Pd
Ag Ag Pd Pd Pd Pd 0 2 o o o 1 5 o o o 2 4 o o o 3 5 o o o 