data_SnMo2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.92
_cell_length_b   2.92
_cell_length_c   9.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   110.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnMo2Au
_chemical_formula_sum   'Sn1 Mo2 Au1'
_cell_volume   74.6
_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
  Sn  Sn3  1  0.0  0.0  0.8  1.0
  Mo  Mo1  1  0.0  0.0  0.19  1.0
  Mo  Mo2  1  0.67  0.0  0.22  1.0
  Au  Au0  1  0.67  0.0  0.14  1.0

data_SnMo2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.92
_cell_length_b   2.92
_cell_length_c   9.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   110.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnMo2Au
_chemical_formula_sum   'Sn1 Mo2 Au1'
_cell_volume   74.6
_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
  Sn  Sn0  1  0.0  0.0  0.8  1.0
  Mo  Mo1  1  0.0  0.0  0.19  1.0
  Mo  Mo2  1  0.67  0.0  0.22  1.0
  Au  Au3  1  0.67  0.0  0.14  1.0

Sn Mo Mo Au