data_AgPd2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87
_cell_length_b   4.87
_cell_length_c   4.95
_cell_angle_alpha   106.94
_cell_angle_beta   106.94
_cell_angle_gamma   37.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgPd2Se
_chemical_formula_sum   'Ag1 Pd2 Se1'
_cell_volume   68.34
_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  0.84  0.0  0.35  1.0
  Pd  Pd1  1  0.3  0.0  0.6  1.0
  Pd  Pd2  1  0.38  0.0  0.11  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_AgPd2Se
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   4.87
_cell_length_c   4.95
_cell_angle_alpha   106.94
_cell_angle_beta   90.0
_cell_angle_gamma   108.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgPd2Se
_chemical_formula_sum   'Ag1 Pd2 Se1'
_cell_volume   68.34
_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  0.16  0.65  1.0
  Pd  Pd1  1  0.0  0.62  0.89  1.0
  Pd  Pd2  1  0.0  0.7  0.4  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

Ag Pd Pd Se