data_MgAlOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.37
_cell_length_b   4.37
_cell_length_c   2.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgAlOs
_chemical_formula_sum   'Mg1 Al1 Os1'
_cell_volume   46.18
_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
  Mg  Mg1  1  0.0  0.0  0.9  1.0
  Al  Al0  1  1.0  0.52  0.62  1.0
  Os  Os2  1  0.19  0.26  0.06  1.0

data_MgAlOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.37
_cell_length_c   4.37
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgAlOs
_chemical_formula_sum   'Mg1 Al1 Os1'
_cell_volume   46.18
_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
  Mg  Mg0  1  0.9  0.0  0.0  1.0
  Al  Al1  1  0.62  1.0  0.52  1.0
  Os  Os2  1  0.06  0.19  0.26  1.0

Mg Al Os
Mg Al Os 0 2 o o + 0 1 - - o 0 1 - o o 1 2 + o o 1 2 + o + 