data_Ag4Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.33
_cell_length_b   8.33
_cell_length_c   8.33
_cell_angle_alpha   109.47
_cell_angle_beta   109.47
_cell_angle_gamma   109.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag4Te
_chemical_formula_sum   'Ag16 Te4'
_cell_volume   445.62
_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  0.2  0.2  0.2  1.0
  Ag  Ag1  1  0.38  0.62  0.62  1.0
  Ag  Ag2  1  0.62  0.38  0.62  1.0
  Ag  Ag3  1  0.62  0.62  0.38  1.0
  Ag  Ag4  1  0.0  0.0  0.26  1.0
  Ag  Ag5  1  0.0  0.0  0.36  1.0
  Ag  Ag6  1  0.0  0.26  0.0  1.0
  Ag  Ag7  1  0.0  0.36  0.0  1.0
  Ag  Ag8  1  0.26  0.0  0.0  1.0
  Ag  Ag9  1  0.36  0.0  0.0  1.0
  Ag  Ag10  1  0.81  0.0  0.41  1.0
  Ag  Ag11  1  0.0  0.81  0.41  1.0
  Ag  Ag12  1  0.0  0.41  0.81  1.0
  Ag  Ag13  1  0.81  0.41  0.0  1.0
  Ag  Ag14  1  0.41  0.81  0.0  1.0
  Ag  Ag15  1  0.41  0.0  0.81  1.0
  Te  Te16  1  0.6  0.6  0.6  1.0
  Te  Te17  1  0.78  0.22  0.22  1.0
  Te  Te18  1  0.22  0.78  0.22  1.0
  Te  Te19  1  0.22  0.22  0.78  1.0

data_Ag4Te
_symmetry_space_group_name_H-M   R3m
_cell_length_a   13.61
_cell_length_b   13.61
_cell_length_c   8.33
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Ag4Te
_chemical_formula_sum   'Ag48 Te12'
_cell_volume   1336.87
_cell_formula_units_Z   12
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+2/3, y+1/3, z+1/3'
  8  '-y+2/3, x-y+1/3, z+1/3'
  9  '-x+y+2/3, -x+1/3, z+1/3'
  10  '-y+2/3, -x+1/3, z+1/3'
  11  '-x+y+2/3, y+1/3, z+1/3'
  12  'x+2/3, x-y+1/3, z+1/3'
  13  'x+1/3, y+2/3, z+2/3'
  14  '-y+1/3, x-y+2/3, z+2/3'
  15  '-x+y+1/3, -x+2/3, z+2/3'
  16  '-y+1/3, -x+2/3, z+2/3'
  17  '-x+y+1/3, y+2/3, z+2/3'
  18  'x+1/3, x-y+2/3, z+2/3'
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  18  0.0  0.41  0.41  1.0
  Ag  Ag1  9  0.08  0.15  0.54  1.0
  Ag  Ag2  9  0.17  0.09  0.09  1.0
  Ag  Ag3  9  0.21  0.43  0.79  1.0
  Ag  Ag4  3  0.0  0.0  0.2  1.0
  Te  Te5  9  0.04  0.52  0.74  1.0
  Te  Te6  3  0.0  0.0  0.6  1.0

Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Te Te Te Te
Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Ag Te Te Te Te 0 4 o o o 0 6 o o o 0 8 o o o 1 16 o o o 2 16 o o o 3 16 o o o 4 5 o o o 4 17 - o o 4 18 o - o 5 10 - o o 5 11 o - o 5 17 - o o 5 18 o - o 5 19 o o o 6 7 o o o 6 17 - o o 6 19 o o - 7 12 o o - 7 13 - o o 7 17 - o o 7 18 o o o 7 19 o o - 8 9 o o o 8 18 o - o 8 19 o o - 9 14 o - o 9 15 o o - 9 17 o o o 9 18 o - o 9 19 o o - 10 17 o o o 10 19 + o o 11 18 o o o 11 19 o + o 12 18 o o + 12 19 o o o 13 17 o o o 13 18 + o o 14 17 o + o 14 18 o o o 15 17 o o + 15 19 o o o 