data_AgSnSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.24
_cell_length_b   3.24
_cell_length_c   9.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgSnSb2
_chemical_formula_sum   'Ag1 Sn1 Sb2'
_cell_volume   100.4
_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
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Sn  Sn3  1  0.0  0.0  0.99  1.0
  Sb  Sb1  1  0.94  0.0  0.23  1.0
  Sb  Sb2  1  0.94  0.0  0.75  1.0

data_AgSnSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   3.24
_cell_length_c   9.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgSnSb2
_chemical_formula_sum   'Ag1 Sn1 Sb2'
_cell_volume   100.4
_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
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.0  0.0  0.99  1.0
  Sb  Sb2  1  0.94  0.0  0.23  1.0
  Sb  Sb3  1  0.94  0.0  0.75  1.0

Ag Sn Sb Sb
Ag Sn Sb Sb 0 1 o o - 0 2 - o o 0 3 - o - 1 2 - o + 1 3 - o o 