data_Mn2HgAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   129.68
_cell_angle_beta   126.73
_cell_angle_gamma   76.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2HgAu
_chemical_formula_sum   'Mn2 Hg1 Au1'
_cell_volume   68.66
_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
  Mn  Mn2  1  0.06  0.0  0.9  1.0
  Mn  Mn3  1  0.0  0.18  0.92  1.0
  Hg  Hg1  1  0.0  0.0  0.82  1.0
  Au  Au0  1  0.0  0.0  0.0  1.0

data_Mn2HgAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.13
_cell_length_b   4.35
_cell_length_c   4.86
_cell_angle_alpha   116.63
_cell_angle_beta   115.16
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2HgAu
_chemical_formula_sum   'Mn2 Hg1 Au1'
_cell_volume   68.66
_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
  Mn  Mn0  1  0.08  0.26  0.26  1.0
  Mn  Mn1  1  0.16  0.1  0.16  1.0
  Hg  Hg2  1  0.18  0.18  0.18  1.0
  Au  Au3  1  0.0  0.0  0.0  1.0

Mn Mn Hg Au