data_[Rb6Ti2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ti  1.5400  1.4000  0.8517
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.1825]
_cell_length_b [6.3790]
_cell_length_c [6.6583]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.3813]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb3TiF6]
_chemical_formula_sum '[Rb6 Ti2 F12]'
_cell_volume [396.6025]
_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  4  0.2420  0.5000  0.2315  1.0
  Rb  Rb1  2  0.0000  0.5000  0.5000  1.0
  Ti  Ti2  2  0.0000  0.0000  0.0000  1.0
  F  F3  8  0.0534  0.2156  0.8479  1.0
  F  F4  4  0.2050  0.0000  0.2977  1.0
]