# generated using pymatgen data_Li13(Si5Pd7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.35217745 _cell_length_b 12.75725494 _cell_length_c 18.49562532 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li13(Si5Pd7)2 _chemical_formula_sum 'Li26 Si20 Pd28' _cell_volume 1026.91109929 _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 Li Li0 1 -0.00000000 0.02074752 0.27366277 1.0 Li Li1 1 -0.00000000 0.97925248 0.72633723 1.0 Li Li2 1 0.50000000 0.47925248 0.77366277 1.0 Li Li3 1 0.50000000 0.52074752 0.22633723 1.0 Li Li4 1 -0.00000000 0.21652566 0.22381110 1.0 Li Li5 1 -0.00000000 0.78347434 0.77618890 1.0 Li Li6 1 0.50000000 0.28347434 0.72381110 1.0 Li Li7 1 0.50000000 0.71652566 0.27618890 1.0 Li Li8 1 0.00000000 0.99242083 0.13782855 1.0 Li Li9 1 0.00000000 0.00757917 0.86217145 1.0 Li Li10 1 0.50000000 0.50757917 0.63782855 1.0 Li Li11 1 0.50000000 0.49242083 0.36217145 1.0 Li Li12 1 -0.00000000 0.20447767 0.64659361 1.0 Li Li13 1 0.00000000 0.79552233 0.35340639 1.0 Li Li14 1 0.50000000 0.29552233 0.14659361 1.0 Li Li15 1 0.50000000 0.70447767 0.85340639 1.0 Li Li16 1 0.00000000 0.00882316 0.58421492 1.0 Li Li17 1 0.00000000 0.99117684 0.41578508 1.0 Li Li18 1 0.50000000 0.49117684 0.08421492 1.0 Li Li19 1 0.50000000 0.50882316 0.91578508 1.0 Li Li20 1 -0.00000000 0.00000000 0.00000000 1.0 Li Li21 1 0.50000000 0.50000000 0.50000000 1.0 Li Li22 1 -0.00000000 0.78847604 0.06316664 1.0 Li Li23 1 -0.00000000 0.21152396 0.93683336 1.0 Li Li24 1 0.50000000 0.71152396 0.56316664 1.0 Li Li25 1 0.50000000 0.28847604 0.43683336 1.0 Si Si26 1 -0.00000000 0.19499738 0.50252692 1.0 Si Si27 1 -0.00000000 0.80500262 0.49747308 1.0 Si Si28 1 0.50000000 0.30500262 0.00252692 1.0 Si Si29 1 0.50000000 0.69499738 0.99747308 1.0 Si Si30 1 -0.00000000 0.38406385 0.30935823 1.0 Si Si31 1 0.00000000 0.61593615 0.69064177 1.0 Si Si32 1 0.50000000 0.11593615 0.80935823 1.0 Si Si33 1 0.50000000 0.88406385 0.19064177 1.0 Si Si34 1 0.00000000 0.38326537 0.56439100 1.0 Si Si35 1 0.00000000 0.61673463 0.43560900 1.0 Si Si36 1 0.50000000 0.11673463 0.06439100 1.0 Si Si37 1 0.50000000 0.88326537 0.93560900 1.0 Si Si38 1 0.00000000 0.37351818 0.06482947 1.0 Si Si39 1 -0.00000000 0.62648182 0.93517053 1.0 Si Si40 1 0.50000000 0.12648182 0.56482947 1.0 Si Si41 1 0.50000000 0.87351818 0.43517053 1.0 Si Si42 1 0.00000000 0.63279564 0.18265190 1.0 Si Si43 1 0.00000000 0.36720436 0.81734810 1.0 Si Si44 1 0.50000000 0.86720436 0.68265190 1.0 Si Si45 1 0.50000000 0.13279564 0.31734810 1.0 Pd Pd46 1 -0.00000000 0.20836262 0.37157767 1.0 Pd Pd47 1 0.00000000 0.79163738 0.62842233 1.0 Pd Pd48 1 0.50000000 0.29163738 0.87157767 1.0 Pd Pd49 1 0.50000000 0.70836262 0.12842233 1.0 Pd Pd50 1 -0.00000000 0.42773623 0.43753619 1.0 Pd Pd51 1 0.00000000 0.57226377 0.56246381 1.0 Pd Pd52 1 0.50000000 0.07226377 0.93753619 1.0 Pd Pd53 1 0.50000000 0.92773623 0.06246381 1.0 Pd Pd54 1 -0.00000000 0.57644914 0.30812656 1.0 Pd Pd55 1 -0.00000000 0.42355086 0.69187344 1.0 Pd Pd56 1 0.50000000 0.92355086 0.80812656 1.0 Pd Pd57 1 0.50000000 0.07644914 0.19187344 1.0 Pd Pd58 1 -0.00000000 0.43837725 0.18441060 1.0 Pd Pd59 1 0.00000000 0.56162275 0.81558940 1.0 Pd Pd60 1 0.50000000 0.06162275 0.68441060 1.0 Pd Pd61 1 0.50000000 0.93837725 0.31558940 1.0 Pd Pd62 1 -0.00000000 0.18745624 0.08454339 1.0 Pd Pd63 1 0.00000000 0.81254376 0.91545661 1.0 Pd Pd64 1 0.50000000 0.31254376 0.58454339 1.0 Pd Pd65 1 0.50000000 0.68745624 0.41545661 1.0 Pd Pd66 1 0.00000000 0.57257829 0.05953431 1.0 Pd Pd67 1 0.00000000 0.42742171 0.94046569 1.0 Pd Pd68 1 0.50000000 0.92742171 0.55953431 1.0 Pd Pd69 1 0.50000000 0.07257829 0.44046569 1.0 Pd Pd70 1 -0.00000000 0.18763183 0.78825605 1.0 Pd Pd71 1 -0.00000000 0.81236817 0.21174395 1.0 Pd Pd72 1 0.50000000 0.31236817 0.28825605 1.0 Pd Pd73 1 0.50000000 0.68763183 0.71174395 1.0