data_[Rb1Li2Mo1Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Li  0.9800  1.4500  0.9000
  Mo  2.1600  1.4500  0.7750
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4789]
_cell_length_b [7.3287]
_cell_length_c [9.3569]
_cell_angle_alpha [85.0371]
_cell_angle_beta [77.4712]
_cell_angle_gamma [64.9038]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbLi2MoBr8]
_chemical_formula_sum '[Rb1 Li2 Mo1 Br8]'
_cell_volume [392.7527]
_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  0.0000  0.5000  1.0
  Li  Li1  2  0.4367  0.5031  0.6748  1.0
  Mo  Mo2  1  0.0000  0.0000  0.0000  1.0
  Br  Br3  2  0.0297  0.7249  0.8318  1.0
  Br  Br4  2  0.2201  0.7206  0.1656  1.0
  Br  Br5  2  0.3656  0.9947  0.8581  1.0
  Br  Br6  2  0.3914  0.2989  0.4971  1.0
]