data_MnIn2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49
_cell_length_b   5.49
_cell_length_c   3.1
_cell_angle_alpha   101.96
_cell_angle_beta   101.96
_cell_angle_gamma   111.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnIn2Au
_chemical_formula_sum   'Mn1 In2 Au1'
_cell_volume   80.76
_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  Mn3  1  0.0  0.0  0.0  1.0
  In  In1  1  0.97  0.73  0.44  1.0
  In  In2  1  0.97  0.27  0.44  1.0
  Au  Au0  1  0.09  0.0  0.0  1.0

data_MnIn2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   5.49
_cell_length_c   5.49
_cell_angle_alpha   111.57
_cell_angle_beta   101.96
_cell_angle_gamma   101.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnIn2Au
_chemical_formula_sum   'Mn1 In2 Au1'
_cell_volume   80.76
_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
  In  In1  1  0.44  0.97  0.27  1.0
  In  In2  1  0.44  0.97  0.73  1.0
  Au  Au3  1  -0.0  0.09  0.0  1.0

Mn In In Au