data_MnOs2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76
_cell_length_b   4.76
_cell_length_c   4.76
_cell_angle_alpha   100.56
_cell_angle_beta   100.56
_cell_angle_gamma   34.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnOs2Au
_chemical_formula_sum   'Mn1 Os2 Au1'
_cell_volume   59.4
_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  0.0  0.0  0.0  1.0
  Os  Os2  1  0.66  0.0  0.6  1.0
  Os  Os3  1  0.53  0.0  0.07  1.0
  Au  Au0  1  0.09  0.0  0.34  1.0

data_MnOs2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.76
_cell_length_c   4.76
_cell_angle_alpha   100.56
_cell_angle_beta   90.0
_cell_angle_gamma   107.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnOs2Au
_chemical_formula_sum   'Mn1 Os2 Au1'
_cell_volume   59.4
_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  0.0  0.0  0.0  1.0
  Os  Os1  1  0.0  0.34  0.4  1.0
  Os  Os2  1  0.0  0.47  0.93  1.0
  Au  Au3  1  0.0  0.91  0.66  1.0

Mn Os Os Au