# generated using pymatgen data_Y3Lu(Nb3Si4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.04552103 _cell_length_b 7.04719117 _cell_length_c 13.01511325 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.96289073 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3Lu(Nb3Si4)2 _chemical_formula_sum 'Y6 Lu2 Nb12 Si16' _cell_volume 646.21499078 _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 Y Y0 1 0.99890223 0.34034644 0.21770678 1.0 Y Y1 1 0.00109777 0.65965356 0.71770678 1.0 Y Y2 1 0.15856394 0.49885555 0.46727859 1.0 Y Y3 1 0.50152048 0.84127647 0.03252878 1.0 Y Y4 1 0.84143606 0.50114445 0.96727859 1.0 Y Y5 1 0.49847952 0.15872353 0.53252878 1.0 Lu Lu6 1 0.34182105 0.00142282 0.78248427 1.0 Lu Lu7 1 0.65817895 0.99857718 0.28248427 1.0 Nb Nb8 1 0.17295427 0.17182205 0.99986138 1.0 Nb Nb9 1 0.82704573 0.82817795 0.49986138 1.0 Nb Nb10 1 0.32857593 0.67232499 0.25003363 1.0 Nb Nb11 1 0.67142407 0.32767501 0.75003363 1.0 Nb Nb12 1 0.15170547 0.99199578 0.37643704 1.0 Nb Nb13 1 0.84829453 0.00800422 0.87643704 1.0 Nb Nb14 1 0.50657123 0.65281399 0.62683590 1.0 Nb Nb15 1 0.34804340 0.49185123 0.87338004 1.0 Nb Nb16 1 0.49342877 0.34718601 0.12683590 1.0 Nb Nb17 1 0.65195660 0.50814877 0.37338004 1.0 Nb Nb18 1 0.99098638 0.15139532 0.62373545 1.0 Nb Nb19 1 0.00901362 0.84860468 0.12373545 1.0 Si Si20 1 0.29636013 0.04643897 0.18772223 1.0 Si Si21 1 0.70363987 0.95356103 0.68772223 1.0 Si Si22 1 0.45378928 0.79488771 0.43635376 1.0 Si Si23 1 0.20697124 0.54694408 0.06287343 1.0 Si Si24 1 0.54621072 0.20511229 0.93635376 1.0 Si Si25 1 0.79302876 0.45305592 0.56287343 1.0 Si Si26 1 0.04796129 0.29244228 0.81276617 1.0 Si Si27 1 0.95203871 0.70755772 0.31276617 1.0 Si Si28 1 0.36790352 0.29302772 0.31766172 1.0 Si Si29 1 0.63209648 0.70697228 0.81766172 1.0 Si Si30 1 0.20535782 0.86642230 0.56815982 1.0 Si Si31 1 0.13627464 0.79661911 0.93123226 1.0 Si Si32 1 0.79464218 0.13357770 0.06815982 1.0 Si Si33 1 0.86372536 0.20338089 0.43123226 1.0 Si Si34 1 0.29481175 0.36417882 0.68294776 1.0 Si Si35 1 0.70518825 0.63582118 0.18294776 1.0