data_[Rb4Mn2F12]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P6_3mc]
_cell_length_a [6.0693]
_cell_length_b [6.0693]
_cell_length_c [9.8922]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [186]
_chemical_formula_structural [Rb2MnF6]
_chemical_formula_sum '[Rb4 Mn2 F12]'
_cell_volume [315.5718]
_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  2  0.0000  0.0000  0.4010  1.0
  Rb  Rb1  2  0.3333  0.6667  0.1274  1.0
  Mn  Mn2  2  0.3333  0.6667  0.7435  1.0
  F  F3  6  0.0479  0.5240  0.8531  1.0
  F  F4  6  0.1867  0.3733  0.6396  1.0
]