data_BaAg2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.3
_cell_length_b   4.35
_cell_length_c   6.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAg2Pt
_chemical_formula_sum   'Ba1 Ag2 Pt1'
_cell_volume   93.35
_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  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.65  0.18  0.57  1.0
  Ag  Ag1  1  0.65  0.18  0.94  1.0
  Pt  Pt3  1  0.0  0.0  0.25  1.0

data_BaAg2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.3
_cell_length_b   4.35
_cell_length_c   6.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAg2Pt
_chemical_formula_sum   'Ba1 Ag2 Pt1'
_cell_volume   93.35
_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  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.65  0.18  0.57  1.0
  Ag  Ag2  1  0.65  0.18  0.94  1.0
  Pt  Pt3  1  0.0  0.0  0.25  1.0

Ba Ag Ag Pt
Ba Ag Ag Pt 0 2 - o - 0 3 o o o 1 3 + o o 1 2 o o o 