# generated using pymatgen
data_Li3RuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84041514
_cell_length_b   5.04937901
_cell_length_c   5.07518396
_cell_angle_alpha   69.96736892
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3RuO4
_chemical_formula_sum   'Li6 Ru2 O8'
_cell_volume   140.61420293
_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
  Li  Li0  1  0.86517515  0.75000000  0.50000000  1
  Li  Li1  1  0.39242512  0.75000000  0.50000000  1
  Li  Li2  1  0.62045311  0.75000000  0.00000000  1
  Li  Li3  1  0.60757488  0.25000000  0.50000000  1
  Li  Li4  1  0.13482485  0.25000000  0.50000000  1
  Li  Li5  1  0.37954689  0.25000000  0.00000000  1
  Ru  Ru6  1  0.85649011  0.25000000  0.00000000  1
  Ru  Ru7  1  0.14350989  0.75000000  0.00000000  1
  O  O8  1  0.88630738  0.00429399  0.77120744  1
  O  O9  1  0.11369262  0.50429399  0.77120744  1
  O  O10  1  0.36192389  0.51739062  0.24165543  1
  O  O11  1  0.36192389  0.98260938  0.75834457  1
  O  O12  1  0.63807611  0.01739062  0.24165543  1
  O  O13  1  0.63807611  0.48260938  0.75834457  1
  O  O14  1  0.88630738  0.49570601  0.22879256  1
  O  O15  1  0.11369262  0.99570601  0.22879256  1
