data_BaYAg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78
_cell_length_b   3.91
_cell_length_c   7.76
_cell_angle_alpha   90.0
_cell_angle_beta   93.17
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYAg2
_chemical_formula_sum   'Ba1 Y1 Ag2'
_cell_volume   114.28
_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
  Ba  Ba2  1  0.79  0.0  0.87  1.0
  Y  Y3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.82  0.95  0.53  1.0
  Ag  Ag1  1  0.52  0.95  0.22  1.0

data_BaYAg2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.78
_cell_length_b   3.91
_cell_length_c   7.76
_cell_angle_alpha   90.0
_cell_angle_beta   93.17
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYAg2
_chemical_formula_sum   'Ba1 Y1 Ag2'
_cell_volume   114.28
_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
  Ba  Ba0  1  0.79  0.0  0.87  1.0
  Y  Y1  1  0.0  0.0  0.0  1.0
  Ag  Ag2  1  0.52  0.95  0.22  1.0
  Ag  Ag3  1  0.82  0.95  0.53  1.0

Ba Y Ag Ag