data_[Rb6La2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  La  1.1000  1.9500  1.1720
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.8037]
_cell_length_b [7.0414]
_cell_length_c [11.7446]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3121]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Rb3LaF6]
_chemical_formula_sum '[Rb6 La2 F12]'
_cell_volume [464.7357]
_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  0.2744  0.5496  0.2568  1.0
  Rb  Rb1  2  0.5000  0.0000  0.5000  1.0
  La  La2  2  0.0000  0.0000  0.0000  1.0
  F  F3  4  0.1039  0.5645  0.7233  1.0
  F  F4  4  0.2498  0.2329  0.5766  1.0
  F  F5  4  0.3295  0.6787  0.5513  1.0
]