data_Ba2ZnAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88
_cell_length_b   4.88
_cell_length_c   8.56
_cell_angle_alpha   105.95
_cell_angle_beta   105.95
_cell_angle_gamma   58.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2ZnAg
_chemical_formula_sum   'Ba2 Zn1 Ag1'
_cell_volume   165.41
_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  Ba1  1  0.71  0.0  0.1  1.0
  Ba  Ba2  1  0.09  0.0  0.03  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.9  0.0  0.06  1.0

data_Ba2ZnAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.79
_cell_length_b   4.88
_cell_length_c   8.56
_cell_angle_alpha   105.95
_cell_angle_beta   90.0
_cell_angle_gamma   119.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2ZnAg
_chemical_formula_sum   'Ba2 Zn1 Ag1'
_cell_volume   165.41
_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  0.29  0.9  1.0
  Ba  Ba1  1  0.0  0.91  0.97  1.0
  Zn  Zn2  1  0.0  0.0  0.0  1.0
  Ag  Ag3  1  0.0  0.1  0.94  1.0

Ba Ba Zn Ag
Ba Ba Zn Ag 0 3 o o o 1 2 o o o 2 3 - o o 