# generated using pymatgen data_Ge13Sb13Te32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.35538678 _cell_length_b 12.42291707 _cell_length_c 12.26784295 _cell_angle_alpha 90.00502507 _cell_angle_beta 90.25590119 _cell_angle_gamma 88.61684884 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ge13Sb13Te32 _chemical_formula_sum 'Ge13 Sb13 Te32' _cell_volume 1882.42312292 _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 Ge Ge0 1 0.22793195 0.23966438 0.00196688 1.0 Ge Ge1 1 0.73742715 0.23470184 0.99965688 1.0 Ge Ge2 1 0.24262307 0.72510438 0.00080687 1.0 Ge Ge3 1 0.23078490 0.99008635 0.25022749 1.0 Ge Ge4 1 0.74356407 0.99460927 0.25377688 1.0 Ge Ge5 1 0.73230325 0.49096225 0.25967854 1.0 Ge Ge6 1 0.50489146 0.73095175 0.24834308 1.0 Ge Ge7 1 0.73715690 0.23566108 0.49678866 1.0 Ge Ge8 1 0.51367427 0.50678720 0.49844711 1.0 Ge Ge9 1 0.73756981 0.72297404 0.49961495 1.0 Ge Ge10 1 0.24392680 0.99464696 0.74832218 1.0 Ge Ge11 1 0.99838786 0.23846957 0.75513138 1.0 Ge Ge12 1 0.73916898 0.49662772 0.76567792 1.0 Sb Sb13 1 0.99579563 0.02080655 0.00284885 1.0 Sb Sb14 1 0.50172669 0.00955464 0.99759934 1.0 Sb Sb15 1 0.74386778 0.72464016 0.99573087 1.0 Sb Sb16 1 0.51457793 0.23884302 0.24809158 1.0 Sb Sb17 1 0.22491762 0.48918315 0.24349123 1.0 Sb Sb18 1 0.99726663 0.73696155 0.24836137 1.0 Sb Sb19 1 0.99136218 0.01772124 0.49903045 1.0 Sb Sb20 1 0.22615490 0.23599996 0.49597229 1.0 Sb Sb21 1 0.24075356 0.73354838 0.49762821 1.0 Sb Sb22 1 0.51026824 0.22978862 0.74744801 1.0 Sb Sb23 1 0.23096567 0.49223310 0.75779485 1.0 Sb Sb24 1 0.99508899 0.72938797 0.75146174 1.0 Sb Sb25 1 0.50594279 0.73126195 0.74112988 1.0 Te Te26 1 0.25036431 0.01286950 0.00150268 1.0 Te Te27 1 0.75323940 0.01189058 0.00302735 1.0 Te Te28 1 0.00423606 0.25776682 0.99207794 1.0 Te Te29 1 0.51017375 0.25884338 0.99678300 1.0 Te Te30 1 0.27585095 0.50581586 0.00099966 1.0 Te Te31 1 0.76045704 0.50047763 0.99633659 1.0 Te Te32 1 0.01002246 0.76381672 0.99883223 1.0 Te Te33 1 0.50158793 0.76379230 0.00485705 1.0 Te Te34 1 0.00900462 0.00619645 0.24909372 1.0 Te Te35 1 0.51459629 0.00582815 0.25361775 1.0 Te Te36 1 0.25311103 0.25375108 0.24445260 1.0 Te Te37 1 0.75232220 0.26110674 0.25217461 1.0 Te Te38 1 0.99679391 0.50525194 0.25122009 1.0 Te Te39 1 0.50795894 0.51088837 0.25468451 1.0 Te Te40 1 0.25850162 0.75613411 0.24450667 1.0 Te Te41 1 0.74849977 0.75811505 0.25728517 1.0 Te Te42 1 0.25827657 0.00728929 0.49968232 1.0 Te Te43 1 0.75490540 0.01322070 0.49398439 1.0 Te Te44 1 0.99670526 0.25829764 0.50485300 1.0 Te Te45 1 0.51125232 0.26589668 0.50010157 1.0 Te Te46 1 0.26258276 0.50409613 0.49982429 1.0 Te Te47 1 0.75073620 0.50534551 0.49411632 1.0 Te Te48 1 0.00130756 0.76192357 0.50078594 1.0 Te Te49 1 0.50909979 0.75765510 0.49684592 1.0 Te Te50 1 0.01059179 0.01145875 0.75077853 1.0 Te Te51 1 0.49920288 0.00330785 0.75153989 1.0 Te Te52 1 0.24975180 0.25591158 0.75579884 1.0 Te Te53 1 0.75613496 0.26614496 0.75316155 1.0 Te Te54 1 0.00032827 0.49910777 0.74306973 1.0 Te Te55 1 0.51111989 0.50247961 0.74718710 1.0 Te Te56 1 0.25122276 0.75859015 0.75524192 1.0 Te Te57 1 0.75196246 0.75555291 0.74654957 1.0