# generated using pymatgen data_Sc9Te2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.77351562 _cell_length_b 8.70483551 _cell_length_c 17.34507398 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 116.54560327 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc9Te2 _chemical_formula_sum 'Sc36 Te8' _cell_volume 1049.96027857 _cell_formula_units_Z 4 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 Sc Sc0 1 0.20707036 0.85371773 0.86840007 1.0 Sc Sc1 1 0.64695088 0.85369756 0.86851459 1.0 Sc Sc2 1 0.79292964 0.14628227 0.36840007 1.0 Sc Sc3 1 0.35304912 0.14630244 0.36851459 1.0 Sc Sc4 1 0.95698677 0.35090445 0.64072456 1.0 Sc Sc5 1 0.39380113 0.35116160 0.64063435 1.0 Sc Sc6 1 0.04301323 0.64909555 0.14072456 1.0 Sc Sc7 1 0.60619887 0.64883840 0.14063435 1.0 Sc Sc8 1 0.26513340 0.53136436 0.79388580 1.0 Sc Sc9 1 0.73486660 0.46863564 0.29388580 1.0 Sc Sc10 1 0.42296907 0.84540252 0.43173504 1.0 Sc Sc11 1 0.57703093 0.15459748 0.93173504 1.0 Sc Sc12 1 0.38670932 0.77445512 0.02361775 1.0 Sc Sc13 1 0.61329068 0.22554488 0.52361775 1.0 Sc Sc14 1 0.20580251 0.97928669 0.56030059 1.0 Sc Sc15 1 0.77251404 0.97862992 0.56044664 1.0 Sc Sc16 1 0.79419749 0.02071331 0.06030059 1.0 Sc Sc17 1 0.22748596 0.02137008 0.06044664 1.0 Sc Sc18 1 0.01515256 0.03137840 0.71649813 1.0 Sc Sc19 1 0.98484744 0.96862160 0.21649813 1.0 Sc Sc20 1 0.06908832 0.13672786 0.92436810 1.0 Sc Sc21 1 0.93091168 0.86327214 0.42436810 1.0 Sc Sc22 1 0.52569819 0.05202650 0.70224740 1.0 Sc Sc23 1 0.47430181 0.94797350 0.20224740 1.0 Sc Sc24 1 0.86324744 0.72510208 0.98375707 1.0 Sc Sc25 1 0.13675256 0.27489792 0.48375707 1.0 Sc Sc26 1 0.97819331 0.52201315 0.44914990 1.0 Sc Sc27 1 0.54380926 0.52149587 0.44924915 1.0 Sc Sc28 1 0.02180669 0.47798685 0.94914990 1.0 Sc Sc29 1 0.45619074 0.47850413 0.94924915 1.0 Sc Sc30 1 0.77614441 0.55200593 0.80708714 1.0 Sc Sc31 1 0.22385559 0.44799407 0.30708714 1.0 Sc Sc32 1 0.32592548 0.65279582 0.57948354 1.0 Sc Sc33 1 0.67407452 0.34720418 0.07948354 1.0 Sc Sc34 1 0.81851765 0.63616439 0.58576473 1.0 Sc Sc35 1 0.18148235 0.36383561 0.08576473 1.0 Te Te36 1 0.12206109 0.74152322 0.70335943 1.0 Te Te37 1 0.61876941 0.74090551 0.70336041 1.0 Te Te38 1 0.87793891 0.25847678 0.20335943 1.0 Te Te39 1 0.38123059 0.25909449 0.20336041 1.0 Te Te40 1 0.86714160 0.24106443 0.80656708 1.0 Te Te41 1 0.37408253 0.24171100 0.80641055 1.0 Te Te42 1 0.13285840 0.75893557 0.30656708 1.0 Te Te43 1 0.62591747 0.75828900 0.30641055 1.0