data_SrSb2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87
_cell_length_b   5.87
_cell_length_c   5.34
_cell_angle_alpha   108.46
_cell_angle_beta   108.46
_cell_angle_gamma   43.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSb2Au
_chemical_formula_sum   'Sr1 Sb2 Au1'
_cell_volume   119.24
_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
  Sr  Sr3  1  0.5  0.0  0.52  1.0
  Sb  Sb1  1  0.16  0.0  0.14  1.0
  Sb  Sb2  1  0.48  0.0  0.32  1.0
  Au  Au0  1  0.49  0.0  0.54  1.0

data_SrSb2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.36
_cell_length_b   5.34
_cell_length_c   5.87
_cell_angle_alpha   108.46
_cell_angle_beta   111.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSb2Au
_chemical_formula_sum   'Sr1 Sb2 Au1'
_cell_volume   119.24
_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
  Sr  Sr0  1  0.0  0.52  0.5  1.0
  Sb  Sb1  1  0.0  0.14  0.16  1.0
  Sb  Sb2  1  0.0  0.32  0.48  1.0
  Au  Au3  1  0.0  0.54  0.49  1.0

Sr Sb Sb Au
Sr Sb Sb Au 0 3 o o o 0 2 o o o 1 2 o o o 2 3 o o o 