data_SbP2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83
_cell_length_b   3.83
_cell_length_c   10.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbP2Au
_chemical_formula_sum   'Sb2 P4 Au2'
_cell_volume   158.47
_cell_formula_units_Z   2
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
  Sb  Sb6  1  0.91  0.0  0.3  1.0
  Sb  Sb7  1  0.0  0.91  0.5  1.0
  P  P2  1  0.91  0.0  0.41  1.0
  P  P3  1  0.0  0.91  0.4  1.0
  P  P4  1  0.0  0.0  0.0  1.0
  P  P5  1  0.91  0.91  0.0  1.0
  Au  Au0  1  0.0  0.0  0.4  1.0
  Au  Au1  1  0.91  0.91  0.4  1.0

data_SbP2Au
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.41
_cell_length_b   5.41
_cell_length_c   10.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SbP2Au
_chemical_formula_sum   'Sb4 P8 Au4'
_cell_volume   316.93
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Sb  Sb0  2  0.0  0.0  0.5  1.0
  Sb  Sb1  2  0.41  0.5  0.3  1.0
  P  P2  4  0.46  0.46  0.0  1.0
  P  P3  2  0.0  0.0  0.4  1.0
  P  P4  2  0.41  0.5  0.41  1.0
  Au  Au5  4  0.46  0.46  0.4  1.0

Sb Sb P P P P Au Au
Sb Sb P P P P Au Au 0 3 + - o 0 7 o - o 0 6 + o o 0 2 o o o 1 2 - + o 1 7 - o o 1 6 o + o 1 3 o o o 2 7 o - o 2 6 + o o 3 7 - o o 3 6 o + o 4 5 - - o 