data_[Li7Bi1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.5146]
_cell_length_b [5.5704]
_cell_length_c [6.0260]
_cell_angle_alpha [63.2757]
_cell_angle_beta [64.6018]
_cell_angle_gamma [61.4266]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li7BiO6]
_chemical_formula_sum '[Li7 Bi1 O6]'
_cell_volume [139.6993]
_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
[
  Li  Li0  1  0.1062  0.7426  0.6216  1.0
  Li  Li1  1  0.3706  0.3338  0.9737  1.0
  Li  Li2  1  0.4791  0.1440  0.6137  1.0
  Li  Li3  1  0.5009  0.8975  0.3725  1.0
  Li  Li4  1  0.6046  0.6321  0.0718  1.0
  Li  Li5  1  0.8089  0.4935  0.6186  1.0
  Li  Li6  1  0.9172  0.2359  0.3495  1.0
  Bi  Bi7  1  0.0076  0.9800  0.0055  1.0
  O  O8  1  0.1033  0.3680  0.7799  1.0
  O  O9  1  0.2400  0.9152  0.2461  1.0
  O  O10  1  0.3975  0.7528  0.7607  1.0
  O  O11  1  0.6229  0.2220  0.2352  1.0
  O  O12  1  0.7820  0.1032  0.7297  1.0
  O  O13  1  0.8692  0.6245  0.2436  1.0
]