data_[Rb1H2Os1Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  H  2.2000  0.2500  0.0000
  Os  2.2000  1.3000  0.6730
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.7619]
_cell_length_b [7.2027]
_cell_length_c [9.4936]
_cell_angle_alpha [70.6645]
_cell_angle_beta [82.1651]
_cell_angle_gamma [69.2777]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbH2OsBr8]
_chemical_formula_sum '[Rb1 H2 Os1 Br8]'
_cell_volume [407.9735]
_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
[
  Rb  Rb0  1  0.0000  0.5000  0.5000  1.0
  H  H1  2  0.3145  0.8639  0.6553  1.0
  Os  Os2  1  0.0000  0.0000  0.0000  1.0
  Br  Br3  2  0.0951  0.2090  0.1208  1.0
  Br  Br4  2  0.2662  0.6786  0.1495  1.0
  Br  Br5  2  0.2817  0.0541  0.8020  1.0
  Br  Br6  2  0.3571  0.7682  0.5323  1.0
]