data_[Rb1Ru1Br1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ru  2.2000  1.3000  0.6610
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.1414]
_cell_length_b [7.1905]
_cell_length_c [7.3390]
_cell_angle_alpha [65.6316]
_cell_angle_beta [63.5258]
_cell_angle_gamma [72.7963]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbRuBrCl6]
_chemical_formula_sum '[Rb1 Ru1 Br1 Cl6]'
_cell_volume [304.3785]
_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  0.3657  0.3409  0.3277  1.0
  Ru  Ru1  1  0.6642  0.6428  0.5293  1.0
  Br  Br2  1  0.8943  0.1587  0.9847  1.0
  Cl  Cl3  1  0.4096  0.4390  0.8021  1.0
  Cl  Cl4  1  0.4608  0.7930  0.3182  1.0
  Cl  Cl5  1  0.5274  0.9007  0.6807  1.0
  Cl  Cl6  1  0.8300  0.3836  0.3765  1.0
  Cl  Cl7  1  0.8952  0.5103  0.7266  1.0
  Cl  Cl8  1  0.9527  0.8309  0.2540  1.0
]