# generated using pymatgen data_Ba8Tl2Bi2Pb4O17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.45778600 _cell_length_b 6.45941474 _cell_length_c 16.01815386 _cell_angle_alpha 91.70002106 _cell_angle_beta 90.95738781 _cell_angle_gamma 93.23413943 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba8Tl2Bi2Pb4O17 _chemical_formula_sum 'Ba8 Tl2 Bi2 Pb4 O17' _cell_volume 666.70260692 _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 0.98218400 0.51324000 0.87849400 1.0 Ba Ba1 1 0.50848900 0.01861300 0.62384700 1.0 Ba Ba2 1 0.52946700 0.00522300 0.87250800 1.0 Ba Ba3 1 0.99367700 0.47660400 0.39254700 1.0 Ba Ba4 1 0.99691700 0.51383400 0.62909800 1.0 Ba Ba5 1 0.49685800 0.98060400 0.14073500 1.0 Ba Ba6 1 0.49391100 0.99424800 0.39059100 1.0 Ba Ba7 1 0.00211500 0.49221500 0.14044000 1.0 Tl Tl8 1 0.00115600 0.99944000 0.52863600 1.0 Tl Tl9 1 0.50315600 0.51204200 0.99342600 1.0 Bi Bi10 1 0.02017300 0.01393300 0.74421000 1.0 Bi Bi11 1 0.48771600 0.47943100 0.25458800 1.0 Pb Pb12 1 0.49343100 0.50875000 0.77157500 1.0 Pb Pb13 1 0.49669500 0.50932200 0.53150700 1.0 Pb Pb14 1 0.00768000 0.00708000 0.00664600 1.0 Pb Pb15 1 0.98781000 0.97187800 0.29009900 1.0 O O16 1 0.77825400 0.73779500 0.75128800 1.0 O O17 1 0.28152900 0.77546400 0.73244000 1.0 O O18 1 0.10666900 0.08550900 0.87566900 1.0 O O19 1 0.26428700 0.25241300 0.47689100 1.0 O O20 1 0.75121300 0.24339700 0.74478800 1.0 O O21 1 0.74700900 0.25858300 0.49919500 1.0 O O22 1 0.25849100 0.27622000 0.70499400 1.0 O O23 1 0.75080500 0.73335200 0.22016900 1.0 O O24 1 0.24820500 0.73651800 0.49282600 1.0 O O25 1 0.24528800 0.76504400 0.23915700 1.0 O O26 1 0.73276700 0.74127000 0.47634500 1.0 O O27 1 0.70726200 0.22097400 0.25743800 1.0 O O28 1 0.75563600 0.28010500 0.98243500 1.0 O O29 1 0.19349900 0.25778600 0.25305700 1.0 O O30 1 0.43711900 0.40871600 0.12301200 1.0 O O31 1 0.22611600 0.71786400 0.99866000 1.0 O O32 1 0.73507300 0.79187300 0.98268700 1.0