# generated using pymatgen
data_Ba2LiTbIrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.13542791
_cell_length_b   6.04325113
_cell_length_c   6.13542733
_cell_angle_alpha   60.49575372
_cell_angle_beta   57.54238383
_cell_angle_gamma   60.49574683
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LiTbIrO6
_chemical_formula_sum   'Ba2 Li1 Tb1 Ir1 O6'
_cell_volume   158.79082803
_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  0.29432500  0.20567500  0.29432500  1
  Ba  Ba1  1  0.70567500  0.79432500  0.70567500  1
  Li  Li2  1  0.00000000  0.50000000  0.00000000  1
  Tb  Tb3  1  0.50000000  0.50000000  0.50000000  1
  Ir  Ir4  1  0.00000000  0.00000000  0.00000000  1
  O  O5  1  0.23032400  0.74975700  0.76967600  1
  O  O6  1  0.23243300  0.76756700  0.23243300  1
  O  O7  1  0.76756700  0.23243300  0.76756700  1
  O  O8  1  0.23032400  0.25024300  0.76967600  1
  O  O9  1  0.76967600  0.25024300  0.23032400  1
  O  O10  1  0.76967600  0.74975700  0.23032400  1
