data_image0 _chemical_formula_structural O24Sc16 _chemical_formula_sum "O24 Sc16" _cell_length_a 8.510646417289818 _cell_length_b 8.510646417289818 _cell_length_c 8.510646417289818 _cell_angle_alpha 109.47122063449069 _cell_angle_beta 109.47122063449069 _cell_angle_gamma 109.47122063449069 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz '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 O O1 1.0 0.04686866560000002 0.2739383396 0.011607522299999985 1.0000 O O2 1.0 0.4883930883 0.7623314279 0.035261143299999985 1.0000 O O3 1.0 0.2739383396 0.011607522299999985 0.04686866560000002 1.0000 O O4 1.0 0.2729299188999999 0.7376693862000001 0.22606227090000003 1.0000 O O5 1.0 0.453131945 0.46473946720000003 0.22706967400000003 1.0000 O O6 1.0 0.9647390602000001 0.5116071152000001 0.23766979320000006 1.0000 O O7 1.0 0.7739379326 0.7270692670000001 0.2623308173000001 1.0000 O O8 1.0 0.7376693862000001 0.22606227089999997 0.2729299189 1.0000 O O9 1.0 0.011607522300000008 0.04686866559999999 0.2739383396 1.0000 O O10 1.0 0.46473946720000003 0.22706967400000003 0.453131945 1.0000 O O11 1.0 0.22706967400000003 0.453131945 0.46473946720000003 1.0000 O O12 1.0 0.7623314279 0.035261143300000033 0.4883930883 1.0000 O O13 1.0 0.23766979319999998 0.9647390602000001 0.5116071152 1.0000 O O14 1.0 0.7729305295 0.5468682585 0.5352617539 1.0000 O O15 1.0 0.5352617539000001 0.7729305295 0.5468682585000001 1.0000 O O16 1.0 0.9883936988 0.9531325555000001 0.7260628815 1.0000 O O17 1.0 0.26233081729999985 0.7739379326 0.7270692669999999 1.0000 O O18 1.0 0.2260622709000001 0.2729299189 0.7376693862 1.0000 O O19 1.0 0.03526114330000002 0.4883930883 0.7623314279 1.0000 O O20 1.0 0.5468682585 0.5352617539000001 0.7729305295 1.0000 O O21 1.0 0.7270692669999999 0.2623308173 0.7739379326000001 1.0000 O O22 1.0 0.7260628815 0.9883936988 0.9531325555000001 1.0000 O O23 1.0 0.5116071152000001 0.2376697932 0.9647390602000001 1.0000 O O24 1.0 0.9531325555000001 0.7260628815 0.9883936988 1.0000 Sc Sc1 1.0 0.4999995930000001 0.0 0.0 1.0000 Sc Sc2 1.0 0.0 0.4999995930000001 0.0 1.0000 Sc Sc3 1.0 0.7500004070000001 0.785709285 0.03570887799999996 1.0000 Sc Sc4 1.0 0.9642903079000001 0.24999979649999998 0.21429091850000004 1.0000 Sc Sc5 1.0 0.7142905114 0.464290715 0.24999979649999998 1.0000 Sc Sc6 1.0 0.21429091850000004 0.9642903079000001 0.24999979650000012 1.0000 Sc Sc7 1.0 0.5357084709999999 0.7499993895000001 0.28570867450000004 1.0000 Sc Sc8 1.0 0.24999979649999998 0.7142905114000001 0.464290715 1.0000 Sc Sc9 1.0 0.0 0.0 0.4999995930000001 1.0000 Sc Sc10 1.0 0.4999995930000001 0.4999995930000001 0.4999995930000001 1.0000 Sc Sc11 1.0 0.7499993895000001 0.2857086745 0.535708471 1.0000 Sc Sc12 1.0 0.464290715 0.24999979650000004 0.7142905114 1.0000 Sc Sc13 1.0 0.28570867450000015 0.535708471 0.7499993895000001 1.0000 Sc Sc14 1.0 0.7857092849999999 0.03570887799999999 0.750000407 1.0000 Sc Sc15 1.0 0.03570887800000004 0.7500004070000001 0.7857092850000001 1.0000 Sc Sc16 1.0 0.24999979650000012 0.21429091849999998 0.9642903079000001 1.0000