# generated using pymatgen data_Ba7(Al3Te8)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.01628200 _cell_length_b 7.03713280 _cell_length_c 45.94332549 _cell_angle_alpha 89.46523187 _cell_angle_beta 89.48720311 _cell_angle_gamma 68.38139366 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba7(Al3Te8)2 _chemical_formula_sum 'Ba14 Al12 Te32' _cell_volume 2108.73183184 _cell_formula_units_Z 2 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 0.26193600 0.76100400 0.99929500 1.0 Ba Ba1 1 0.76293500 0.26155700 0.24742400 1.0 Ba Ba2 1 0.74751900 0.24289000 0.12686600 1.0 Ba Ba3 1 0.21168000 0.71950800 0.36656100 1.0 Ba Ba4 1 0.24442400 0.74448300 0.24767200 1.0 Ba Ba5 1 0.74917800 0.25524400 0.49977100 1.0 Ba Ba6 1 0.78122200 0.28977800 0.36610800 1.0 Ba Ba7 1 0.24469500 0.75019600 0.62433000 1.0 Ba Ba8 1 0.24403200 0.74943300 0.50021500 1.0 Ba Ba9 1 0.74150800 0.24341900 0.74929100 1.0 Ba Ba10 1 0.74911000 0.25474300 0.62486700 1.0 Ba Ba11 1 0.27361900 0.78343800 0.88534700 1.0 Ba Ba12 1 0.25683300 0.75738800 0.74974900 1.0 Ba Ba13 1 0.70949500 0.21589300 0.88568800 1.0 Al Al14 1 0.50376000 0.99771100 0.06252500 1.0 Al Al15 1 0.01676500 0.50257900 0.18585300 1.0 Al Al16 1 0.48037900 0.02109100 0.43542100 1.0 Al Al17 1 0.49854100 0.00374800 0.31214600 1.0 Al Al18 1 0.00114600 0.50107100 0.56399800 1.0 Al Al19 1 0.00410500 0.49542400 0.43868700 1.0 Al Al20 1 0.50193300 0.00067000 0.68655000 1.0 Al Al21 1 0.50051400 0.99844400 0.56292100 1.0 Al Al22 1 0.98164100 0.51888400 0.81419900 1.0 Al Al23 1 0.00160200 0.49758400 0.68654500 1.0 Al Al24 1 0.50192400 0.99506000 0.81160800 1.0 Al Al25 1 0.98934700 0.48949600 0.93906200 1.0 Te Te26 1 0.21899600 0.27504900 0.03173800 1.0 Te Te27 1 0.76383000 0.72775300 0.14689800 1.0 Te Te28 1 0.64634300 0.60067100 0.06266800 1.0 Te Te29 1 0.90115400 0.85650000 0.06498500 1.0 Te Te30 1 0.29447100 0.20983500 0.26779500 1.0 Te Te31 1 0.07678300 0.11208900 0.18531200 1.0 Te Te32 1 0.40979200 0.44005000 0.18562800 1.0 Te Te33 1 0.23438800 0.27295700 0.09486000 1.0 Te Te34 1 0.75694200 0.74212700 0.39800800 1.0 Te Te35 1 0.53394100 0.61510600 0.31043500 1.0 Te Te36 1 0.88838500 0.96665600 0.31055400 1.0 Te Te37 1 0.77100400 0.73809500 0.22643500 1.0 Te Te38 1 0.28327500 0.21554800 0.51818500 1.0 Te Te39 1 0.05303400 0.09136300 0.43754800 1.0 Te Te40 1 0.40770400 0.44870000 0.43729500 1.0 Te Te41 1 0.32644300 0.17362300 0.36361900 1.0 Te Te42 1 0.78331600 0.71594300 0.64176500 1.0 Te Te43 1 0.53273400 0.60614600 0.56256900 1.0 Te Te44 1 0.89111100 0.97188000 0.56261600 1.0 Te Te45 1 0.76432900 0.73520800 0.48145400 1.0 Te Te46 1 0.25429600 0.24480100 0.76918900 1.0 Te Te47 1 0.03351300 0.10522300 0.68718200 1.0 Te Te48 1 0.39231500 0.47141900 0.68719100 1.0 Te Te49 1 0.29050600 0.20853800 0.60873700 1.0 Te Te50 1 0.81668900 0.67155200 0.88731800 1.0 Te Te51 1 0.56505700 0.58012100 0.81240900 1.0 Te Te52 1 0.91284700 0.93894400 0.81242200 1.0 Te Te53 1 0.79178600 0.70757800 0.73216900 1.0 Te Te54 1 0.02287300 0.10319900 0.94123000 1.0 Te Te55 1 0.37858100 0.44952500 0.94005400 1.0 Te Te56 1 0.24934800 0.24570000 0.85200700 1.0 Te Te57 1 0.79437500 0.70736100 0.98202700 1.0