# generated using pymatgen
data_BaRuO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.93657385
_cell_length_b   7.93765484
_cell_length_c   7.93360130
_cell_angle_alpha   42.71376996
_cell_angle_beta   43.05868620
_cell_angle_gamma   42.71305534
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaRuO3
_chemical_formula_sum   'Ba3 Ru3 O9'
_cell_volume   209.27383937
_cell_formula_units_Z   3
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  0.78223131  0.78187960  0.78223235  1.0
  Ba  Ba1  1  0.21776869  0.21812040  0.21776765  1.0
  Ba  Ba2  1  -0.00000000  0.00000000  -0.00000000  1.0
  Ru  Ru3  1  0.61579654  0.61916830  0.61576122  1.0
  Ru  Ru4  1  0.38420346  0.38083170  0.38423878  1.0
  Ru  Ru5  1  0.50000000  0.50000000  0.50000000  1.0
  O  O6  1  0.71218700  0.24880218  0.71150237  1.0
  O  O7  1  0.24547714  0.71324042  0.71825441  1.0
  O  O8  1  0.71838900  0.71267736  0.24539169  1.0
  O  O9  1  0.28781300  0.75119782  0.28849763  1.0
  O  O10  1  0.75452286  0.28675958  0.28174559  1.0
  O  O11  1  0.28161100  0.28732264  0.75460831  1.0
  O  O12  1  0.50000000  0.50000000  -0.00000000  1.0
  O  O13  1  -0.00000000  0.50000000  0.50000000  1.0
  O  O14  1  0.50000000  0.00000000  0.50000000  1.0