data_La2AlW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.51
_cell_length_b   11.51
_cell_length_c   11.51
_cell_angle_alpha   15.51
_cell_angle_beta   15.51
_cell_angle_gamma   15.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2AlW
_chemical_formula_sum   'La2 Al1 W1'
_cell_volume   95.06
_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  La1  1  0.0  0.0  0.46  1.0
  La  La2  1  0.0  0.0  0.65  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.0  0.06  1.0

data_La2AlW
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.38
_cell_length_b   3.11
_cell_length_c   11.51
_cell_angle_alpha   90.0
_cell_angle_beta   98.96
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   La2AlW
_chemical_formula_sum   'La4 Al2 W2'
_cell_volume   190.12
_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  0.35  1.0
  La  La1  2  0.0  0.0  0.54  1.0
  Al  Al2  2  0.0  0.0  0.0  1.0
  W  W3  2  0.0  0.0  0.94  1.0

La La Al W
La La Al W 0 1 o o o 2 3 o o o 