data_SrIrOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06
_cell_length_b   6.06
_cell_length_c   6.06
_cell_angle_alpha   152.76
_cell_angle_beta   141.53
_cell_angle_gamma   47.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrIrOs
_chemical_formula_sum   'Sr1 Ir1 Os1'
_cell_volume   63.2
_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
  Sr  Sr2  1  0.0  0.0  0.7  1.0
  Ir  Ir0  1  0.0  0.0  0.52  1.0
  Os  Os1  1  0.0  0.0  0.86  1.0

data_SrIrOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   3.99
_cell_length_c   6.06
_cell_angle_alpha   109.23
_cell_angle_beta   103.62
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrIrOs
_chemical_formula_sum   'Sr1 Ir1 Os1'
_cell_volume   63.2
_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
  Sr  Sr0  1  0.0  0.7  0.7  1.0
  Ir  Ir1  1  0.0  0.52  0.52  1.0
  Os  Os2  1  0.0  0.86  0.86  1.0

Sr Ir Os
Sr Ir Os 0 1 o o o 0 2 o o o 