data_[Ta2Ti2Sb2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Ti  1.5400  1.4000  0.8517
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.8777]
_cell_length_b [5.5943]
_cell_length_c [8.7235]
_cell_angle_alpha [87.6486]
_cell_angle_beta [73.8387]
_cell_angle_gamma [89.7610]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TaTiSbO6]
_chemical_formula_sum '[Ta2 Ti2 Sb2 O12]'
_cell_volume [228.4356]
_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
[
  Ta  Ta0  2  0.0647  0.8276  0.3490  1.0
  Ti  Ti1  2  0.4090  0.6711  0.6530  1.0
  Sb  Sb2  2  0.3006  0.2575  0.9983  1.0
  O  O3  2  0.1080  0.4204  0.7267  1.0
  O  O4  2  0.1746  0.9144  0.7242  1.0
  O  O5  2  0.2255  0.1489  0.4383  1.0
  O  O6  2  0.3320  0.6513  0.4410  1.0
  O  O7  2  0.3492  0.9144  0.1371  1.0
  O  O8  2  0.4884  0.5832  0.8619  1.0
]