data_AlOs3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   5.02
_cell_angle_alpha   116.74
_cell_angle_beta   116.74
_cell_angle_gamma   116.74
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlOs3
_chemical_formula_sum   'Al1 Os3'
_cell_volume   57.98
_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
  Os  Os1  1  0.86  0.77  0.92  1.0
  Os  Os2  1  0.14  0.77  0.92  1.0
  Os  Os3  1  0.0  0.47  0.92  1.0

data_AlOs3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.75
_cell_length_b   5.02
_cell_length_c   5.02
_cell_angle_alpha   116.74
_cell_angle_beta   100.53
_cell_angle_gamma   100.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlOs3
_chemical_formula_sum   'Al1 Os3'
_cell_volume   57.98
_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
  Os  Os1  1  0.92  0.05  0.15  1.0
  Os  Os2  1  0.92  0.78  0.15  1.0
  Os  Os3  1  0.92  0.92  0.45  1.0

Al Os Os Os