# generated using pymatgen data_Li5Ni9O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.97177000 _cell_length_b 11.27573368 _cell_length_c 10.33402572 _cell_angle_alpha 99.42864082 _cell_angle_beta 77.39486730 _cell_angle_gamma 80.10967592 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Ni9O16 _chemical_formula_sum 'Li10 Ni18 O32' _cell_volume 544.61718358 _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 Li Li0 1 0.94135200 0.05783800 0.75865600 1.0 Li Li1 1 0.47778700 0.50228000 0.00452800 1.0 Li Li2 1 0.87701500 0.12392500 0.49666900 1.0 Li Li3 1 0.69061100 0.31196400 0.74915200 1.0 Li Li4 1 0.62188900 0.37553600 0.50084800 1.0 Li Li5 1 0.43548500 0.56357500 0.75333100 1.0 Li Li6 1 0.83471300 0.18522000 0.24547200 1.0 Li Li7 1 0.37114800 0.62966200 0.49134400 1.0 Li Li8 1 0.19312000 0.81989000 0.74772500 1.0 Li Li9 1 0.11938000 0.86761000 0.50227500 1.0 Ni Ni10 1 0.84993000 0.65036500 0.86835800 1.0 Ni Ni11 1 0.61063000 0.90478700 0.87977100 1.0 Ni Ni12 1 0.96031900 0.53318000 0.37882500 1.0 Ni Ni13 1 0.77716600 0.71722900 0.62539300 1.0 Ni Ni14 1 0.88941300 0.59468800 0.12618600 1.0 Ni Ni15 1 0.53533400 0.97027100 0.62460700 1.0 Ni Ni16 1 0.70187000 0.78271300 0.37022900 1.0 Ni Ni17 1 0.75316800 0.24959900 0.00443600 1.0 Ni Ni18 1 0.55933200 0.43790100 0.24556400 1.0 Ni Ni19 1 0.35218100 0.15432000 0.87117500 1.0 Ni Ni20 1 0.09141500 0.40463700 0.88436000 1.0 Ni Ni21 1 0.46257000 0.03713500 0.38164200 1.0 Ni Ni22 1 0.28057800 0.22174300 0.62697100 1.0 Ni Ni23 1 0.23752500 0.75431400 0.00839100 1.0 Ni Ni24 1 0.07497500 0.93318600 0.24160900 1.0 Ni Ni25 1 0.42308700 0.09281200 0.12381400 1.0 Ni Ni26 1 0.03192200 0.46575700 0.62302900 1.0 Ni Ni27 1 0.22108500 0.28286300 0.36564000 1.0 O O28 1 0.94053600 0.79957400 0.91361400 1.0 O O29 1 0.84804100 0.89223100 0.68334300 1.0 O O30 1 0.78871400 0.48924800 0.80173200 1.0 O O31 1 0.97953700 0.30373800 0.56963200 1.0 O O32 1 0.98900500 0.76665300 0.19044800 1.0 O O33 1 0.75929600 0.95903700 0.44501600 1.0 O O34 1 0.73627600 0.53944300 0.55710000 1.0 O O35 1 0.55320400 0.72846300 0.80498400 1.0 O O36 1 0.88149500 0.37861500 0.32559700 1.0 O O37 1 0.65052300 0.08342000 0.93236900 1.0 O O38 1 0.30814200 0.99271000 0.80058600 1.0 O O39 1 0.46445900 0.79526900 0.56665700 1.0 O O40 1 0.66197700 0.60408000 0.31763100 1.0 O O41 1 0.79746600 0.42539200 0.06077900 1.0 O O42 1 0.43100500 0.30888500 0.92440300 1.0 O O43 1 0.57622400 0.14805700 0.69290000 1.0 O O44 1 0.60486000 0.66270100 0.03135800 1.0 O O45 1 0.37196400 0.88792600 0.33638600 1.0 O O46 1 0.70764000 0.02479900 0.21864200 1.0 O O47 1 0.14951200 0.57986200 0.93561800 1.0 O O48 1 0.33296300 0.38376200 0.68036800 1.0 O O49 1 0.52378600 0.19825200 0.44826800 1.0 O O50 1 0.51503400 0.26210800 0.18922100 1.0 O O51 1 0.32349500 0.92084700 0.05955200 1.0 O O52 1 0.26693000 0.45789100 0.44138600 1.0 O O53 1 0.08682900 0.62510800 0.68646200 1.0 O O54 1 0.22567100 0.06239200 0.56353800 1.0 O O55 1 0.04557000 0.22960900 0.80861400 1.0 O O56 1 0.19801600 0.52661700 0.21230500 1.0 O O57 1 0.00435800 0.69479000 0.44941400 1.0 O O58 1 0.16298800 0.10763800 0.31438200 1.0 O O59 1 0.11448400 0.16088300 0.03769500 1.0