# generated using pymatgen
data_Ba2RuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01430036
_cell_length_b   4.01431842
_cell_length_c   7.30700426
_cell_angle_alpha   105.94353060
_cell_angle_beta   105.94345280
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2RuO4
_chemical_formula_sum   'Ba2 Ru1 O4'
_cell_volume   108.50215041
_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
  Ba  Ba0  1  0.35486968  0.35486968  0.70974137  1.0
  Ba  Ba1  1  0.64513032  0.64513032  0.29025863  1.0
  Ru  Ru2  1  -0.00000000  -0.00000000  -0.00000000  1.0
  O  O3  1  0.15276602  0.15276602  0.30553205  1.0
  O  O4  1  0.84723398  0.84723398  0.69446795  1.0
  O  O5  1  -0.00000000  0.50000000  -0.00000000  1.0
  O  O6  1  0.50000000  -0.00000000  -0.00000000  1.0