data_[Sr8Rh2Br1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.4260]
_cell_length_b [7.6906]
_cell_length_c [8.7991]
_cell_angle_alpha [90.0583]
_cell_angle_beta [107.0434]
_cell_angle_gamma [100.9876]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sr8Rh2Br]
_chemical_formula_sum '[Sr8 Rh2 Br1]'
_cell_volume [470.7711]
_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  2  0.2372  0.4009  0.0595  1
  Sr  Sr1  2  0.2385  0.3787  0.5585  1
  Sr  Sr2  2  0.2458  0.8520  0.3217  1
  Sr  Sr3  2  0.2464  0.8524  0.8001  1
  Rh  Rh4  2  0.0010  0.5002  0.7432  1
  Br  Br5  1  0.0000  0.0000  0.0000  1
]