# generated using pymatgen data_Ba2Ta15O32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.71092960 _cell_length_b 12.71092961 _cell_length_c 12.71092891 _cell_angle_alpha 35.78676116 _cell_angle_beta 35.78676115 _cell_angle_gamma 35.78675882 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Ta15O32 _chemical_formula_sum 'Ba2 Ta15 O32' _cell_volume 627.89291266 _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 0.36048308 0.36048308 0.36048308 1.0 Ba Ba1 1 0.63951692 0.63951692 0.63951692 1.0 Ta Ta2 1 0.55581606 0.31768689 0.72345033 1.0 Ta Ta3 1 0.27654967 0.44418394 0.68231311 1.0 Ta Ta4 1 0.68231311 0.27654967 0.44418394 1.0 Ta Ta5 1 0.44418394 0.68231311 0.27654967 1.0 Ta Ta6 1 0.86106391 0.86106391 0.86106391 1.0 Ta Ta7 1 0.13893609 0.13893609 0.13893609 1.0 Ta Ta8 1 0.92698091 0.80578327 0.47045774 1.0 Ta Ta9 1 0.47045774 0.92698091 0.80578327 1.0 Ta Ta10 1 0.80578327 0.47045774 0.92698091 1.0 Ta Ta11 1 0.07301909 0.19421673 0.52954226 1.0 Ta Ta12 1 0.52954226 0.07301909 0.19421673 1.0 Ta Ta13 1 0.19421673 0.52954226 0.07301909 1.0 Ta Ta14 1 -0.00000000 0.00000000 0.00000000 1.0 Ta Ta15 1 0.31768689 0.72345033 0.55581606 1.0 Ta Ta16 1 0.72345033 0.55581606 0.31768689 1.0 O O17 1 0.95756020 0.18284447 0.76439899 1.0 O O18 1 0.76439899 0.95756020 0.18284447 1.0 O O19 1 0.18284447 0.76439899 0.95756020 1.0 O O20 1 0.04243980 0.81715553 0.23560101 1.0 O O21 1 0.23560101 0.04243980 0.81715553 1.0 O O22 1 0.81715553 0.23560101 0.04243980 1.0 O O23 1 0.46767865 0.35192311 0.05906726 1.0 O O24 1 0.05906726 0.46767865 0.35192311 1.0 O O25 1 0.35192311 0.05906726 0.46767865 1.0 O O26 1 0.53232135 0.64807689 0.94093274 1.0 O O27 1 0.94093274 0.53232135 0.64807689 1.0 O O28 1 0.64807689 0.94093274 0.53232135 1.0 O O29 1 0.07257685 0.95511204 0.65981619 1.0 O O30 1 0.65981619 0.07257685 0.95511204 1.0 O O31 1 0.95511204 0.65981619 0.07257685 1.0 O O32 1 0.92742315 0.04488796 0.34018381 1.0 O O33 1 0.34018381 0.92742315 0.04488796 1.0 O O34 1 0.53887929 0.80399557 0.36276226 1.0 O O35 1 0.80399557 0.36276226 0.53887929 1.0 O O36 1 0.36276226 0.53887929 0.80399557 1.0 O O37 1 0.46112071 0.19600443 0.63723774 1.0 O O38 1 0.19600443 0.63723774 0.46112071 1.0 O O39 1 0.63723774 0.46112071 0.19600443 1.0 O O40 1 0.76126827 0.07130204 0.66692872 1.0 O O41 1 0.07130204 0.66692872 0.76126827 1.0 O O42 1 0.66692872 0.76126827 0.07130204 1.0 O O43 1 0.23873173 0.92869796 0.33307128 1.0 O O44 1 0.92869796 0.33307128 0.23873173 1.0 O O45 1 0.33307128 0.23873173 0.92869796 1.0 O O46 1 0.23762431 0.23762431 0.23762431 1.0 O O47 1 0.76237569 0.76237569 0.76237569 1.0 O O48 1 0.04488796 0.34018381 0.92742315 1.0