data_[Rb1Mn1Tl2Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Mn  1.5500  1.4000  0.6483
  Tl  1.6200  1.9000  1.3325
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.5917]
_cell_length_b [7.9204]
_cell_length_c [8.1981]
_cell_angle_alpha [115.0609]
_cell_angle_beta [92.2942]
_cell_angle_gamma [117.5124]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbMn(TlBr3)2]
_chemical_formula_sum '[Rb1 Mn1 Tl2 Br6]'
_cell_volume [378.6162]
_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  0.8121  0.3659  0.1852  1.0
  Mn  Mn1  1  0.3181  0.3597  0.6797  1.0
  Tl  Tl2  1  0.0393  0.8767  0.8880  1.0
  Tl  Tl3  1  0.5299  0.8754  0.4889  1.0
  Br  Br4  1  0.0149  0.3598  0.5706  1.0
  Br  Br5  1  0.0927  0.8994  0.5183  1.0
  Br  Br6  1  0.2369  0.4084  0.9818  1.0
  Br  Br7  1  0.4021  0.3214  0.3811  1.0
  Br  Br8  1  0.5850  0.8369  0.8480  1.0
  Br  Br9  1  0.6307  0.3732  0.7967  1.0
]