data_RbFeCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.98
_cell_length_b   6.98
_cell_length_c   5.87
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   RbFeCl3
_chemical_formula_sum   'Rb2 Fe2 Cl6'
_cell_volume   247.77
_cell_formula_units_Z   2
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  0.49  0.01  0.4  1.0
  Rb  Rb1  1  0.0  0.03  0.47  1.0
  Fe  Fe2  1  0.0  0.0  0.0  1.0
  Fe  Fe3  1  0.0  0.0  0.94  1.0
  Cl  Cl4  1  0.56  0.9  0.47  1.0
  Cl  Cl5  1  0.93  0.14  0.4  1.0
  Cl  Cl6  1  0.42  0.9  0.47  1.0
  Cl  Cl7  1  0.07  0.14  0.4  1.0
  Cl  Cl8  1  0.49  0.24  0.47  1.0
  Cl  Cl9  1  0.0  0.8  0.4  1.0

data_RbFeCl3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.87
_cell_length_b   6.98
_cell_length_c   6.98
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   RbFeCl3
_chemical_formula_sum   'Rb2 Fe2 Cl6'
_cell_volume   247.77
_cell_formula_units_Z   2
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  0.4  0.49  0.01  1.0
  Rb  Rb1  1  0.47  -0.0  0.03  1.0
  Fe  Fe2  1  0.0  0.0  0.0  1.0
  Fe  Fe3  1  0.94  0.0  0.0  1.0
  Cl  Cl4  1  0.4  -0.0  0.8  1.0
  Cl  Cl5  1  0.4  0.07  0.14  1.0
  Cl  Cl6  1  0.4  0.93  0.14  1.0
  Cl  Cl7  1  0.47  0.42  0.9  1.0
  Cl  Cl8  1  0.47  0.49  0.24  1.0
  Cl  Cl9  1  0.47  0.56  0.9  1.0

Rb Rb Fe Fe Cl Cl Cl Cl Cl Cl