# generated using pymatgen data_Yb(Al3Se5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.66784229 _cell_length_b 9.66784210 _cell_length_c 9.51335881 _cell_angle_alpha 90.29579579 _cell_angle_beta 90.29579499 _cell_angle_gamma 89.19278142 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb(Al3Se5)2 _chemical_formula_sum 'Yb2 Al12 Se20' _cell_volume 889.07513733 _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 Yb Yb0 1 0.99807086 0.74767572 0.24965985 1.0 Yb Yb1 1 0.25232428 0.00192914 0.75034015 1.0 Al Al2 1 0.16069428 0.42980995 0.12246776 1.0 Al Al3 1 0.43489338 0.12733101 0.16162824 1.0 Al Al4 1 0.35061358 0.74547852 0.16680397 1.0 Al Al5 1 0.65379749 0.83362091 0.25736236 1.0 Al Al6 1 0.74407303 0.16726409 0.33751697 1.0 Al Al7 1 0.12270512 0.16192168 0.42636614 1.0 Al Al8 1 0.83807832 0.87729488 0.57363386 1.0 Al Al9 1 0.83273591 0.25592697 0.66248303 1.0 Al Al10 1 0.16637909 0.34620251 0.74263764 1.0 Al Al11 1 0.25452148 0.64938642 0.83319603 1.0 Al Al12 1 0.87266899 0.56510662 0.83837176 1.0 Al Al13 1 0.57019005 0.83930572 0.87753224 1.0 Se Se14 1 0.17839292 0.82160708 1.00000000 1.0 Se Se15 1 0.57243046 0.67684146 0.07216236 1.0 Se Se16 1 0.92867829 0.50575557 0.07736384 1.0 Se Se17 1 0.81719458 0.99300701 0.17384990 1.0 Se Se18 1 0.18364817 0.18176684 0.17823395 1.0 Se Se19 1 0.56444348 0.30681340 0.25606745 1.0 Se Se20 1 0.24695308 0.57536846 0.30702569 1.0 Se Se21 1 0.42868636 0.92878465 0.32164706 1.0 Se Se22 1 0.92657059 0.31610962 0.42872338 1.0 Se Se23 1 0.75857901 0.69208550 0.43018672 1.0 Se Se24 1 0.07493172 0.92506828 0.50000000 1.0 Se Se25 1 0.30791450 0.24142099 0.56981328 1.0 Se Se26 1 0.68389038 0.07342941 0.57127662 1.0 Se Se27 1 0.07121535 0.57131364 0.67835294 1.0 Se Se28 1 0.42463154 0.75304692 0.69297431 1.0 Se Se29 1 0.69318660 0.43555652 0.74393255 1.0 Se Se30 1 0.00699299 0.18280542 0.82615010 1.0 Se Se31 1 0.81823316 0.81635183 0.82176605 1.0 Se Se32 1 0.49424443 0.07132171 0.92263616 1.0 Se Se33 1 0.32315854 0.42756954 0.92783764 1.0