data_AlMoOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92
_cell_length_b   6.69
_cell_length_c   2.75
_cell_angle_alpha   83.01
_cell_angle_beta   73.71
_cell_angle_gamma   23.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlMoOs
_chemical_formula_sum   'Al1 Mo1 Os1'
_cell_volume   45.15
_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  0.5  0.31  0.99  1.0
  Mo  Mo1  1  0.5  0.31  0.71  1.0
  Os  Os2  1  0.5  0.31  0.37  1.0

data_AlMoOs
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.0
_cell_length_b   13.04
_cell_length_c   2.75
_cell_angle_alpha   90.0
_cell_angle_beta   122.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   AlMoOs
_chemical_formula_sum   'Al2 Mo2 Os2'
_cell_volume   90.31
_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
  Al  Al0  2  0.49  0.5  0.49  1.0
  Mo  Mo1  2  0.21  0.5  0.21  1.0
  Os  Os2  2  0.37  0.0  0.87  1.0

Al Mo Os
Al Mo Os 0 1 o o o 0 2 o o + 1 2 o o o 