data_BeReOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.37
_cell_length_b   8.37
_cell_length_c   8.37
_cell_angle_alpha   18.87
_cell_angle_beta   18.87
_cell_angle_gamma   18.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeReOs2
_chemical_formula_sum   'Be1 Re1 Os2'
_cell_volume   53.66
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Re  Re3  1  0.0  0.0  0.33  1.0
  Os  Os1  1  0.0  0.0  0.36  1.0
  Os  Os2  1  0.0  0.0  0.3  1.0

data_BeReOs2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.75
_cell_length_b   2.74
_cell_length_c   8.37
_cell_angle_alpha   90.0
_cell_angle_beta   100.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BeReOs2
_chemical_formula_sum   'Be2 Re2 Os4'
_cell_volume   107.31
_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
  Be  Be0  2  0.0  0.0  0.0  1.0
  Re  Re1  2  0.0  0.0  0.67  1.0
  Os  Os2  2  0.0  0.0  0.64  1.0
  Os  Os3  2  0.0  0.0  0.7  1.0

Be Re Os Os