data_Ag3Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.1
_cell_length_b   9.18
_cell_length_c   6.03
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag3Bi
_chemical_formula_sum   'Ag12 Bi4'
_cell_volume   337.56
_cell_formula_units_Z   4
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  0.07  0.89  0.3  1.0
  Ag  Ag1  1  0.07  0.3  0.32  1.0
  Ag  Ag2  1  0.02  0.89  0.71  1.0
  Ag  Ag3  1  0.03  0.3  0.73  1.0
  Ag  Ag4  1  0.45  0.09  0.64  1.0
  Ag  Ag5  1  0.6  0.09  0.63  1.0
  Ag  Ag6  1  0.5  0.5  0.4  1.0
  Ag  Ag7  1  0.65  0.69  0.39  1.0
  Ag  Ag8  1  0.65  0.09  0.39  1.0
  Ag  Ag9  1  0.5  0.09  0.4  1.0
  Ag  Ag10  1  0.6  0.69  0.63  1.0
  Ag  Ag11  1  0.45  0.5  0.64  1.0
  Bi  Bi12  1  0.02  0.89  0.29  1.0
  Bi  Bi13  1  0.03  0.3  0.27  1.0
  Bi  Bi14  1  0.07  0.89  0.76  1.0
  Bi  Bi15  1  0.08  0.3  0.74  1.0

data_Ag3Bi
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.03
_cell_length_b   6.1
_cell_length_c   9.18
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   Ag3Bi
_chemical_formula_sum   'Ag12 Bi4'
_cell_volume   337.56
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  2  0.29  0.02  0.8  1.0
  Ag  Ag1  2  0.3  0.03  0.2  1.0
  Ag  Ag2  2  0.37  0.6  0.59  1.0
  Ag  Ag3  2  0.37  0.6  1.0  1.0
  Ag  Ag4  2  0.39  0.45  0.0  1.0
  Ag  Ag5  2  0.39  0.45  0.41  1.0
  Bi  Bi6  2  0.26  0.98  0.2  1.0
  Bi  Bi7  2  0.27  0.97  0.8  1.0

Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Bi Bi Bi Bi
Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Bi Bi Bi Bi 0 12 o o o 1 13 o o o 2 14 o o o 3 15 o o o 4 5 o o o 6 11 o o o 7 10 o o o 8 9 o o o 