data_AlGeW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   2.76
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlGeW2
_chemical_formula_sum   'Al1 Ge1 W2'
_cell_volume   62.59
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.74  0.0  0.0  1.0
  W  W2  1  0.37  0.93  0.38  1.0
  W  W3  1  0.37  0.07  0.38  1.0

data_AlGeW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   4.97
_cell_length_c   4.97
_cell_angle_alpha   113.02
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlGeW2
_chemical_formula_sum   'Al1 Ge1 W2'
_cell_volume   62.59
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.0  0.74  0.0  1.0
  W  W2  1  0.38  0.37  0.93  1.0
  W  W3  1  0.38  0.37  0.07  1.0

Al Ge W W
Al Ge W W 0 1 - o o 2 3 o + o 