data_InMo2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.81
_cell_length_b   4.23
_cell_length_c   5.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InMo2Au
_chemical_formula_sum   'In1 Mo2 Au1'
_cell_volume   70.59
_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
  In  In1  1  0.0  0.0  0.46  1.0
  Mo  Mo2  1  0.4  0.11  0.13  1.0
  Mo  Mo3  1  0.0  0.0  0.38  1.0
  Au  Au0  1  0.4  0.11  0.94  1.0

data_InMo2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   4.23
_cell_length_c   5.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InMo2Au
_chemical_formula_sum   'In1 Mo2 Au1'
_cell_volume   70.59
_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
  In  In0  1  0.0  0.0  0.46  1.0
  Mo  Mo1  1  0.0  0.0  0.38  1.0
  Mo  Mo2  1  0.4  0.11  0.13  1.0
  Au  Au3  1  0.4  0.11  0.94  1.0

In Mo Mo Au
In Mo Mo Au 0 2 o o o 1 3 o o - 