data_HgSbAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.17
_cell_length_b   4.17
_cell_length_c   6.93
_cell_angle_alpha   104.96
_cell_angle_beta   104.96
_cell_angle_gamma   55.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgSbAu2
_chemical_formula_sum   'Hg1 Sb1 Au2'
_cell_volume   94.62
_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
  Hg  Hg2  1  0.68  0.0  0.31  1.0
  Sb  Sb3  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.03  0.0  0.61  1.0
  Au  Au1  1  0.34  0.0  0.02  1.0

data_HgSbAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.87
_cell_length_b   4.17
_cell_length_c   6.93
_cell_angle_alpha   104.96
_cell_angle_beta   90.0
_cell_angle_gamma   117.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgSbAu2
_chemical_formula_sum   'Hg1 Sb1 Au2'
_cell_volume   94.62
_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
  Hg  Hg0  1  0.0  0.32  0.69  1.0
  Sb  Sb1  1  0.0  0.0  0.0  1.0
  Au  Au2  1  0.0  0.66  0.98  1.0
  Au  Au3  1  0.0  0.97  0.39  1.0

Hg Sb Au Au