data_MnMoAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.54
_cell_length_b   6.51
_cell_length_c   2.75
_cell_angle_alpha   78.37
_cell_angle_beta   77.3
_cell_angle_gamma   24.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnMoAu
_chemical_formula_sum   'Mn1 Mo1 Au1'
_cell_volume   47.05
_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  Mn1  1  0.9  0.99  0.35  1.0
  Mo  Mo2  1  0.9  0.99  0.07  1.0
  Au  Au0  1  0.9  0.99  0.04  1.0

data_MnMoAu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.8
_cell_length_b   12.46
_cell_length_c   2.75
_cell_angle_alpha   90.0
_cell_angle_beta   133.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   MnMoAu
_chemical_formula_sum   'Mn2 Mo2 Au2'
_cell_volume   94.09
_cell_formula_units_Z   2
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
  Mn  Mn0  2  0.4  0.5  0.25  1.0
  Mo  Mo1  2  0.4  0.5  0.97  1.0
  Au  Au2  2  0.4  0.5  0.94  1.0

Mn Mo Au