data_[Rb1Mn2Fe1Cl8]
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
  Fe  1.8300  1.4000  0.8525
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.3594]
_cell_length_b [6.3823]
_cell_length_c [8.9256]
_cell_angle_alpha [74.3058]
_cell_angle_beta [75.0502]
_cell_angle_gamma [74.0431]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbMn2FeCl8]
_chemical_formula_sum '[Rb1 Mn2 Fe1 Cl8]'
_cell_volume [328.6627]
_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
  Mn  Mn1  2  0.4506  0.4496  0.7250  1
  Fe  Fe2  1  0.0000  0.0000  0.0000  1
  Cl  Cl3  2  0.1887  0.7308  0.2109  1
  Cl  Cl4  2  0.2498  0.2348  0.9582  1
  Cl  Cl5  2  0.2586  0.8001  0.7973  1
  Cl  Cl6  2  0.3536  0.3235  0.5245  1
]