# generated using pymatgen data_Li(NiGe)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67223765 _cell_length_b 8.67230365 _cell_length_c 7.74390465 _cell_angle_alpha 89.99998170 _cell_angle_beta 89.99998488 _cell_angle_gamma 119.99770363 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li(NiGe)6 _chemical_formula_sum 'Li3 Ni18 Ge18' _cell_volume 504.38983300 _cell_formula_units_Z 3 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 Li Li0 1 0.33333024 0.66664954 0.00001745 1.0 Li Li1 1 0.66672167 0.33335485 0.00001742 1.0 Li Li2 1 -0.00001909 -0.00000015 0.49996660 1.0 Ni Ni3 1 0.16680200 0.33377334 0.24509415 1.0 Ni Ni4 1 0.83310002 0.16697360 0.24507748 1.0 Ni Ni5 1 0.33394473 0.16699615 0.24508123 1.0 Ni Ni6 1 0.66592071 0.83296726 0.24505918 1.0 Ni Ni7 1 0.16679958 0.83304567 0.24509635 1.0 Ni Ni8 1 0.83311795 0.66621105 0.75489572 1.0 Ni Ni9 1 0.83309667 0.16697613 0.75491173 1.0 Ni Ni10 1 0.83312058 0.66621382 0.24509387 1.0 Ni Ni11 1 0.33394431 0.16699646 0.75490737 1.0 Ni Ni12 1 0.66591985 0.83296670 0.75492901 1.0 Ni Ni13 1 0.16680215 0.33377408 0.75489482 1.0 Ni Ni14 1 0.16680117 0.83304371 0.75489261 1.0 Ni Ni15 1 0.50009033 0.00000745 0.26123308 1.0 Ni Ni16 1 0.50008322 0.50001542 0.26122910 1.0 Ni Ni17 1 0.00007495 0.50000015 0.26124227 1.0 Ni Ni18 1 0.50009154 0.00000792 0.73878712 1.0 Ni Ni19 1 0.50008381 0.50001614 0.73879229 1.0 Ni Ni20 1 0.00007504 0.50000060 0.73877889 1.0 Ge Ge21 1 0.34181252 0.00001500 0.00001414 1.0 Ge Ge22 1 0.34180992 0.34177964 0.00001372 1.0 Ge Ge23 1 0.00001911 0.65822214 0.00001372 1.0 Ge Ge24 1 0.00002172 0.34178975 0.00001379 1.0 Ge Ge25 1 0.65821986 0.65821316 0.00001282 1.0 Ge Ge26 1 0.65820972 0.99998925 0.00001337 1.0 Ge Ge27 1 0.32415062 -0.00000968 0.49998441 1.0 Ge Ge28 1 0.32415472 0.32417281 0.49998481 1.0 Ge Ge29 1 -0.00000902 0.67582913 0.49998469 1.0 Ge Ge30 1 -0.00001186 0.32416209 0.49998452 1.0 Ge Ge31 1 0.67583280 0.67583660 0.49998566 1.0 Ge Ge32 1 0.67584471 0.00000751 0.49998513 1.0 Ge Ge33 1 0.33332919 0.66665166 0.33806321 1.0 Ge Ge34 1 0.66671855 0.33335255 0.33806381 1.0 Ge Ge35 1 0.66671891 0.33335258 0.66196232 1.0 Ge Ge36 1 0.33332892 0.66665141 0.66196316 1.0 Ge Ge37 1 -0.00002743 -0.00000184 0.16103684 1.0 Ge Ge38 1 -0.00002737 -0.00000165 0.83892015 1.0