data_KSb2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   3.07
_cell_angle_alpha   90.81
_cell_angle_beta   90.81
_cell_angle_gamma   115.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KSb2Au
_chemical_formula_sum   'K1 Sb2 Au1'
_cell_volume   106.53
_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
  K  K1  1  0.0  0.0  0.0  1.0
  Sb  Sb2  1  0.61  0.37  0.53  1.0
  Sb  Sb3  1  0.61  0.63  0.53  1.0
  Au  Au0  1  0.3  0.0  0.0  1.0

data_KSb2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.07
_cell_length_b   6.21
_cell_length_c   6.21
_cell_angle_alpha   115.8
_cell_angle_beta   90.81
_cell_angle_gamma   90.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KSb2Au
_chemical_formula_sum   'K1 Sb2 Au1'
_cell_volume   106.53
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.53  0.61  0.37  1.0
  Sb  Sb2  1  0.53  0.61  0.63  1.0
  Au  Au3  1  0.0  0.3  0.0  1.0

K Sb Sb Au