data_Ge2OsBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.21
_cell_length_b   3.91
_cell_length_c   6.09
_cell_angle_alpha   90.0
_cell_angle_beta   97.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2OsBr
_chemical_formula_sum   'Ge2 Os1 Br1'
_cell_volume   99.28
_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
  Ge  Ge1  1  0.37  0.95  0.24  1.0
  Ge  Ge2  1  0.87  0.0  0.52  1.0
  Os  Os3  1  0.74  0.95  0.48  1.0
  Br  Br0  1  0.49  0.0  0.85  1.0

data_Ge2OsBr
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.91
_cell_length_b   4.21
_cell_length_c   6.09
_cell_angle_alpha   97.8
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2OsBr
_chemical_formula_sum   'Ge2 Os1 Br1'
_cell_volume   99.28
_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
  Ge  Ge0  1  0.0  0.13  0.48  1.0
  Ge  Ge1  1  0.05  0.63  0.76  1.0
  Os  Os2  1  0.05  0.26  0.52  1.0
  Br  Br3  1  0.0  0.51  0.15  1.0

Ge Ge Os Br