data_La2SnMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.18
_cell_length_b   10.18
_cell_length_c   10.18
_cell_angle_alpha   20.53
_cell_angle_beta   20.53
_cell_angle_gamma   20.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2SnMo
_chemical_formula_sum   'La2 Sn1 Mo1'
_cell_volume   113.54
_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
  La  La0  1  0.0  0.0  0.1  1.0
  La  La1  1  0.0  0.0  0.78  1.0
  Sn  Sn3  1  0.0  0.0  0.94  1.0
  Mo  Mo2  1  0.0  0.0  0.0  1.0

data_La2SnMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.28
_cell_length_b   3.63
_cell_length_c   10.18
_cell_angle_alpha   90.0
_cell_angle_beta   101.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   La2SnMo
_chemical_formula_sum   'La4 Sn2 Mo2'
_cell_volume   227.07
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  La  La0  2  0.0  0.0  0.22  1.0
  La  La1  2  0.0  0.0  0.9  1.0
  Sn  Sn2  2  0.0  0.0  0.06  1.0
  Mo  Mo3  2  0.0  0.0  0.0  1.0

La La Sn Mo
La La Sn Mo 0 3 o o o 1 2 o o o 2 3 o o + 