data_[Li7Ru1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ru  2.2000  1.3000  0.6610
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.3307]
_cell_length_b [5.4208]
_cell_length_c [5.8137]
_cell_angle_alpha [90.9810]
_cell_angle_beta [115.9580]
_cell_angle_gamma [119.2045]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li7RuO6]
_chemical_formula_sum '[Li7 Ru1 O6]'
_cell_volume [126.0258]
_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  0.1534  0.2550  0.6350  1.0
  Li  Li1  1  0.2868  0.6303  0.9956  1.0
  Li  Li2  1  0.3915  0.8611  0.6281  1.0
  Li  Li3  1  0.5961  0.1036  0.3576  1.0
  Li  Li4  1  0.7000  0.5085  0.6184  1.0
  Li  Li5  1  0.7476  0.3594  0.0438  1.0
  Li  Li6  1  0.8510  0.7598  0.3416  1.0
  Ru  Ru7  1  0.0065  0.0094  0.0044  1.0
  O  O8  1  0.1137  0.8975  0.7416  1.0
  O  O9  1  0.1556  0.7818  0.2310  1.0
  O  O10  1  0.4681  0.3694  0.2209  1.0
  O  O11  1  0.5515  0.6346  0.8026  1.0
  O  O12  1  0.8411  0.2331  0.7604  1.0
  O  O13  1  0.8642  0.0946  0.2409  1.0
]