data_[K6V2F14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  V  1.6300  1.3500  0.7775
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.2298]
_cell_length_b [8.7479]
_cell_length_c [6.2939]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8706]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [K3VF7]
_chemical_formula_sum '[K6 V2 F14]'
_cell_volume [380.5746]
_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
[
  K  K0  4  0.0002  0.2361  0.4995  1.0
  K  K1  2  0.4710  0.0000  0.9488  1.0
  V  V2  2  0.4580  0.5000  0.9770  1.0
  F  F3  4  0.1534  0.1378  0.2371  1.0
  F  F4  4  0.3889  0.2928  0.8350  1.0
  F  F5  2  0.0996  0.0000  0.8117  1.0
  F  F6  2  0.1682  0.5000  0.6952  1.0
  F  F7  2  0.3436  0.5000  0.1743  1.0
]