data_SrReOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16
_cell_length_b   5.16
_cell_length_c   2.74
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrReOs2
_chemical_formula_sum   'Sr1 Re1 Os2'
_cell_volume   70.01
_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  Sr3  1  0.0  0.0  0.0  1.0
  Re  Re2  1  0.09  0.0  0.0  1.0
  Os  Os0  1  0.55  0.06  0.37  1.0
  Os  Os1  1  0.55  0.94  0.37  1.0

data_SrReOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   5.16
_cell_length_c   5.16
_cell_angle_alpha   106.27
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrReOs2
_chemical_formula_sum   'Sr1 Re1 Os2'
_cell_volume   70.01
_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  0.0  0.0  1.0
  Re  Re1  1  0.0  0.09  0.0  1.0
  Os  Os2  1  0.37  0.55  0.06  1.0
  Os  Os3  1  0.37  0.55  0.94  1.0

Sr Re Os Os