data_[K2Li1Nb6P3O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  Nb  1.6000  1.4500  0.8200
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [8.5313]
_cell_length_b [8.5420]
_cell_length_c [8.5451]
_cell_angle_alpha [104.0795]
_cell_angle_beta [104.1952]
_cell_angle_gamma [104.1742]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [K2LiNb6(PO8)3]
_chemical_formula_sum '[K2 Li1 Nb6 P3 O24]'
_cell_volume [554.0177]
_cell_formula_units_Z [1]
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  1  0.3046  0.5942  0.9113  1
  K  K1  1  0.6950  0.0892  0.4058  1
  Li  Li2  1  0.5791  0.5790  0.5770  1
  Nb  Nb3  1  0.0406  0.3576  0.1638  1
  Nb  Nb4  1  0.1606  0.0388  0.3570  1
  Nb  Nb5  1  0.3539  0.1599  0.0382  1
  Nb  Nb6  1  0.6555  0.9733  0.8497  1
  Nb  Nb7  1  0.8487  0.6529  0.9730  1
  Nb  Nb8  1  0.9714  0.8463  0.6526  1
  P  P9  1  0.2759  0.7245  0.4997  1
  P  P10  1  0.4997  0.2762  0.7238  1
  P  P11  1  0.7238  0.4998  0.2754  1
  O  O12  1  0.0015  0.8474  0.1534  1
  O  O13  1  0.0241  0.9712  0.4963  1
  O  O14  1  0.0630  0.2028  0.3096  1
  O  O15  1  0.1350  0.7121  0.5843  1
  O  O16  1  0.1537  0.0005  0.8472  1
  O  O17  1  0.2061  0.3141  0.0649  1
  O  O18  1  0.2344  0.5523  0.3584  1
  O  O19  1  0.2911  0.8680  0.4196  1
  O  O20  1  0.3144  0.0657  0.2065  1
  O  O21  1  0.3594  0.2348  0.5506  1
  O  O22  1  0.4190  0.2921  0.8671  1
  O  O23  1  0.4483  0.7511  0.6343  1
  O  O24  1  0.4982  0.0263  0.9729  1
  O  O25  1  0.5528  0.3571  0.2365  1
  O  O26  1  0.5831  0.1341  0.7090  1
  O  O27  1  0.6321  0.4507  0.7531  1
  O  O28  1  0.6829  0.7899  0.9269  1
  O  O29  1  0.7099  0.5824  0.1330  1
  O  O30  1  0.7539  0.6334  0.4491  1
  O  O31  1  0.7902  0.9278  0.6833  1
  O  O32  1  0.8473  0.1536  0.0024  1
  O  O33  1  0.8664  0.4176  0.2888  1
  O  O34  1  0.9294  0.6879  0.7935  1
  O  O35  1  0.9751  0.4998  0.0281  1
]