data_Al2GeOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87
_cell_length_b   2.87
_cell_length_c   8.57
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2GeOs
_chemical_formula_sum   'Al2 Ge1 Os1'
_cell_volume   64.48
_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  0.57  0.0  0.24  1.0
  Al  Al1  1  0.57  0.0  0.33  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.0  0.28  1.0

data_Al2GeOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   2.87
_cell_length_c   8.57
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2GeOs
_chemical_formula_sum   'Al2 Ge1 Os1'
_cell_volume   64.48
_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  0.57  0.0  0.24  1.0
  Al  Al1  1  0.57  0.0  0.33  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.0  0.28  1.0

Al Al Ge Os
Al Al Ge Os 0 1 o o o 0 2 + o o 0 2 o o o 0 3 + o o 1 2 + o o 1 3 + o o 2 2 + + o 2 2 o + o 2 2 + o o 2 3 o o o 