data_[K9Ta10O30]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ta  1.5000  1.4500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [8.9975]
_cell_length_b [8.9982]
_cell_length_c [8.9981]
_cell_angle_alpha [90.0030]
_cell_angle_beta [101.5399]
_cell_angle_gamma [113.5812]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [K9Ta10O30]
_chemical_formula_sum '[K9 Ta10 O30]'
_cell_volume [651.5636]
_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  2  0.0000  0.6005  0.8003  1
  K  K1  2  0.0005  0.7998  0.4002  1
  K  K2  2  0.4999  0.3993  0.6998  1
  K  K3  2  0.5000  0.1999  0.1008  1
  K  K4  1  0.0000  0.0000  0.0000  1
  Ta  Ta5  2  0.2491  0.3997  0.9498  1
  Ta  Ta6  2  0.2512  0.9990  0.7479  1
  Ta  Ta7  2  0.2518  0.6031  0.5488  1
  Ta  Ta8  2  0.2522  0.1985  0.3521  1
  Ta  Ta9  2  0.2533  0.8029  0.1531  1
  O  O10  2  0.0001  0.9001  0.6998  1
  O  O11  2  0.0002  0.7001  0.1002  1
  O  O12  2  0.2480  0.0000  0.2480  1
  O  O13  2  0.2480  0.6976  0.3487  1
  O  O14  2  0.2480  0.1008  0.5505  1
  O  O15  2  0.2481  0.7984  0.6512  1
  O  O16  2  0.2501  0.2999  0.1501  1
  O  O17  2  0.2501  0.6001  0.0502  1
  O  O18  2  0.2501  0.5002  0.7499  1
  O  O19  2  0.2502  0.2000  0.8499  1
  O  O20  2  0.2502  0.4001  0.4500  1
  O  O21  2  0.2503  0.9001  0.9501  1
  O  O22  2  0.4999  0.1008  0.8024  1
  O  O23  2  0.5000  0.3024  0.3992  1
  O  O24  1  0.0000  0.5000  0.5000  1
  O  O25  1  0.5000  0.5000  0.0000  1
]