data_AlMo2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   5.06
_cell_angle_alpha   95.76
_cell_angle_beta   95.76
_cell_angle_gamma   32.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlMo2Au
_chemical_formula_sum   'Al1 Mo2 Au1'
_cell_volume   64.47
_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
  Al  Al0  1  0.37  0.0  0.46  1.0
  Mo  Mo2  1  0.53  0.0  0.93  1.0
  Mo  Mo3  1  0.89  0.0  0.84  1.0
  Au  Au1  1  0.85  0.0  0.36  1.0

data_AlMo2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.75
_cell_length_b   4.85
_cell_length_c   5.06
_cell_angle_alpha   95.76
_cell_angle_beta   90.0
_cell_angle_gamma   106.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlMo2Au
_chemical_formula_sum   'Al1 Mo2 Au1'
_cell_volume   64.47
_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
  Al  Al0  1  0.0  0.63  0.54  1.0
  Mo  Mo1  1  0.0  0.11  0.16  1.0
  Mo  Mo2  1  0.0  0.47  0.07  1.0
  Au  Au3  1  0.0  0.15  0.64  1.0

Al Mo Mo Au