data_AgSnPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12
_cell_length_b   5.12
_cell_length_c   5.12
_cell_angle_alpha   133.65
_cell_angle_beta   133.65
_cell_angle_gamma   67.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgSnPd2
_chemical_formula_sum   'Ag1 Sn1 Pd2'
_cell_volume   69.21
_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  0.0  0.0  0.26  1.0
  Sn  Sn3  1  0.02  0.0  0.13  1.0
  Pd  Pd1  1  0.0  0.02  0.13  1.0
  Pd  Pd2  1  0.0  0.0  0.0  1.0

data_AgSnPd2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.7
_cell_length_b   5.7
_cell_length_c   5.12
_cell_angle_alpha   90.0
_cell_angle_beta   123.81
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   AgSnPd2
_chemical_formula_sum   'Ag2 Sn2 Pd4'
_cell_volume   138.41
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.0  0.0  0.26  1.0
  Sn  Sn1  2  0.49  0.5  0.11  1.0
  Pd  Pd2  2  0.0  0.0  0.0  1.0
  Pd  Pd3  2  0.49  0.5  0.11  1.0

Ag Sn Pd Pd
Ag Sn Pd Pd 0 2 o o o 0 1 o o o 1 2 o o o 1 3 o o o 2 3 o o o 