# generated using pymatgen
data_Ba2Sr(IrO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77706024
_cell_length_b   5.77706024
_cell_length_c   29.69039600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000279
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Sr(IrO3)3
_chemical_formula_sum   'Ba8 Sr4 Ir12 O36'
_cell_volume   858.14445856
_cell_formula_units_Z   4
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  0.66666700  0.33333300  0.16681000  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.83319000  1.0
  Ba  Ba2  1  0.00000000  0.00000000  0.41656900  1.0
  Ba  Ba3  1  0.00000000  0.00000000  0.08170900  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.74868200  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.58343100  1.0
  Ba  Ba6  1  0.00000000  0.00000000  0.25131800  1.0
  Ba  Ba7  1  0.00000000  0.00000000  0.91829100  1.0
  Sr  Sr8  1  0.33333300  0.66666700  0.33260700  1.0
  Sr  Sr9  1  0.33333300  0.66666700  0.00000000  1.0
  Sr  Sr10  1  0.33333300  0.66666700  0.66739300  1.0
  Sr  Sr11  1  0.66666700  0.33333300  0.50000000  1.0
  Ir  Ir12  1  0.33333300  0.66666700  0.45491200  1.0
  Ir  Ir13  1  0.33333300  0.66666700  0.12138500  1.0
  Ir  Ir14  1  0.33333300  0.66666700  0.78811100  1.0
  Ir  Ir15  1  0.66666700  0.33333300  0.37878300  1.0
  Ir  Ir16  1  0.66666700  0.33333300  0.04516600  1.0
  Ir  Ir17  1  0.66666700  0.33333300  0.71140800  1.0
  Ir  Ir18  1  0.66666700  0.33333300  0.28859200  1.0
  Ir  Ir19  1  0.66666700  0.33333300  0.95483400  1.0
  Ir  Ir20  1  0.66666700  0.33333300  0.62121700  1.0
  Ir  Ir21  1  0.33333300  0.66666700  0.54508800  1.0
  Ir  Ir22  1  0.33333300  0.66666700  0.21188900  1.0
  Ir  Ir23  1  0.33333300  0.66666700  0.87861500  1.0
  O  O24  1  0.82007200  0.17992800  0.33376000  1.0
  O  O25  1  0.81988600  0.18011400  0.00000000  1.0
  O  O26  1  0.82007200  0.17992800  0.66624000  1.0
  O  O27  1  0.82007200  0.64014500  0.33376000  1.0
  O  O28  1  0.81988600  0.63977200  0.00000000  1.0
  O  O29  1  0.82007200  0.64014500  0.66624000  1.0
  O  O30  1  0.35985500  0.17992800  0.33376000  1.0
  O  O31  1  0.36022800  0.18011400  0.00000000  1.0
  O  O32  1  0.35985500  0.17992800  0.66624000  1.0
  O  O33  1  0.17975700  0.82024300  0.50000000  1.0
  O  O34  1  0.18053200  0.81946800  0.16660600  1.0
  O  O35  1  0.18053200  0.81946800  0.83339400  1.0
  O  O36  1  0.17975700  0.35951400  0.50000000  1.0
  O  O37  1  0.18053200  0.36106400  0.16660600  1.0
  O  O38  1  0.18053200  0.36106400  0.83339400  1.0
  O  O39  1  0.64048600  0.82024300  0.50000000  1.0
  O  O40  1  0.63893600  0.81946800  0.16660600  1.0
  O  O41  1  0.63893600  0.81946800  0.83339400  1.0
  O  O42  1  0.50003000  0.49997000  0.41684700  1.0
  O  O43  1  0.49649100  0.50350900  0.08142100  1.0
  O  O44  1  0.49659400  0.50340600  0.74790200  1.0
  O  O45  1  0.50003000  0.00006100  0.41684700  1.0
  O  O46  1  0.49649100  0.99298300  0.08142100  1.0
  O  O47  1  0.49659400  0.99318800  0.74790200  1.0
  O  O48  1  0.99993900  0.49997000  0.41684700  1.0
  O  O49  1  0.00701700  0.50350900  0.08142100  1.0
  O  O50  1  0.00681200  0.50340600  0.74790200  1.0
  O  O51  1  0.50003000  0.49997000  0.58315300  1.0
  O  O52  1  0.49659400  0.50340600  0.25209800  1.0
  O  O53  1  0.49649100  0.50350900  0.91857900  1.0
  O  O54  1  0.50003000  0.00006100  0.58315300  1.0
  O  O55  1  0.49659400  0.99318800  0.25209800  1.0
  O  O56  1  0.49649100  0.99298300  0.91857900  1.0
  O  O57  1  0.00681200  0.50340600  0.25209800  1.0
  O  O58  1  0.00701700  0.50350900  0.91857900  1.0
  O  O59  1  0.99993900  0.49997000  0.58315300  1.0