data_Ag2BiPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.33
_cell_length_b   3.33
_cell_length_c   7.25
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag2BiPd
_chemical_formula_sum   'Ag2 Bi1 Pd1'
_cell_volume   80.54
_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
  Ag  Ag0  1  0.31  0.0  0.07  1.0
  Ag  Ag1  1  0.0  0.0  0.71  1.0
  Bi  Bi2  1  0.31  0.0  0.41  1.0
  Pd  Pd3  1  0.0  0.0  0.7  1.0

data_Ag2BiPd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.33
_cell_length_b   3.33
_cell_length_c   7.25
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Ag2BiPd
_chemical_formula_sum   'Ag2 Bi1 Pd1'
_cell_volume   80.6
_cell_formula_units_Z   1
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  1  0.0  0.0  0.71  1.0
  Ag  Ag1  1  0.31  0.0  0.07  1.0
  Bi  Bi2  1  0.31  0.0  0.41  1.0
  Pd  Pd3  1  0.0  0.0  0.7  1.0

Ag Ag Bi Pd
Ag Ag Bi Pd 0 3 o o - 0 1 o o - 0 2 o o o 1 3 o o o 1 2 o o o 2 3 o o o 