# generated using pymatgen data_Li8Mn7Ni(PO4)12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.56084100 _cell_length_b 8.77755817 _cell_length_c 11.97581452 _cell_angle_alpha 90.37906100 _cell_angle_beta 90.02739485 _cell_angle_gamma 90.09141158 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li8Mn7Ni(PO4)12 _chemical_formula_sum 'Li8 Mn7 Ni1 P12 O48' _cell_volume 899.88103513 _cell_formula_units_Z 1 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 0.78283500 0.27686700 0.18110400 1.0 Li Li1 1 0.78564400 0.22067700 0.81877200 1.0 Li Li2 1 0.71599100 0.77799100 0.31718400 1.0 Li Li3 1 0.71404600 0.72046100 0.68023800 1.0 Li Li4 1 0.28486300 0.28182700 0.32174100 1.0 Li Li5 1 0.28239400 0.22828400 0.68073500 1.0 Li Li6 1 0.21511100 0.77825900 0.18144200 1.0 Li Li7 1 0.21742800 0.72083700 0.81523400 1.0 Mn Mn8 1 0.75234500 0.03630100 0.61248200 1.0 Mn Mn9 1 0.75271700 0.46402700 0.38659100 1.0 Mn Mn10 1 0.74945900 0.96359700 0.11430800 1.0 Mn Mn11 1 0.74875700 0.53451600 0.88558300 1.0 Mn Mn12 1 0.25256600 0.46469400 0.11422400 1.0 Mn Mn13 1 0.25143600 0.03772200 0.88485400 1.0 Mn Mn14 1 0.24653000 0.96314200 0.38691000 1.0 Ni Ni15 1 0.24888100 0.53644700 0.61694500 1.0 P P16 1 0.96355400 0.75156100 0.50072800 1.0 P P17 1 0.53462500 0.25324500 0.99999300 1.0 P P18 1 0.46414300 0.74880700 0.99948700 1.0 P P19 1 0.03509500 0.24773000 0.50064300 1.0 P P20 1 0.89469500 0.60322200 0.14749900 1.0 P P21 1 0.89487600 0.89314900 0.85320700 1.0 P P22 1 0.60681400 0.38937200 0.64654600 1.0 P P23 1 0.60545500 0.10518400 0.35355400 1.0 P P24 1 0.39376400 0.89619800 0.64734600 1.0 P P25 1 0.39604600 0.60760500 0.35357700 1.0 P P26 1 0.10582900 0.39580000 0.85656600 1.0 P P27 1 0.10646700 0.10773400 0.14631700 1.0 O O28 1 0.94029200 0.35297000 0.42345800 1.0 O O29 1 0.93978900 0.13728900 0.57396700 1.0 O O30 1 0.92604000 0.10557000 0.15716700 1.0 O O31 1 0.92327100 0.39365400 0.84659900 1.0 O O32 1 0.85250000 0.84315300 0.58227000 1.0 O O33 1 0.85309500 0.66716200 0.41734100 1.0 O O34 1 0.84393300 0.56109700 0.02810100 1.0 O O35 1 0.84489500 0.93877000 0.97088100 1.0 O O36 1 0.84428300 0.76329400 0.18214600 1.0 O O37 1 0.84034700 0.73021600 0.82020600 1.0 O O38 1 0.82377200 0.48037200 0.22625300 1.0 O O39 1 0.82159600 0.01332600 0.77291900 1.0 O O40 1 0.67857400 0.98459700 0.27397000 1.0 O O41 1 0.68462700 0.51102100 0.72656100 1.0 O O42 1 0.66853700 0.22760500 0.67743100 1.0 O O43 1 0.65634700 0.26763900 0.32052800 1.0 O O44 1 0.65667600 0.43848100 0.52864200 1.0 O O45 1 0.65443500 0.06235800 0.47255600 1.0 O O46 1 0.64167300 0.16983300 0.08154500 1.0 O O47 1 0.64126200 0.33939900 0.91476900 1.0 O O48 1 0.57633500 0.90109800 0.65637600 1.0 O O49 1 0.57716400 0.60468000 0.33927100 1.0 O O50 1 0.55725500 0.85692600 0.07480600 1.0 O O51 1 0.55775300 0.64032200 0.92377000 1.0 O O52 1 0.44017400 0.36234000 0.07515400 1.0 O O53 1 0.44151400 0.14331400 0.92469100 1.0 O O54 1 0.43050800 0.38964600 0.65957200 1.0 O O55 1 0.42423900 0.10309200 0.34274600 1.0 O O56 1 0.35433300 0.66045300 0.08202800 1.0 O O57 1 0.35545300 0.83528700 0.91796000 1.0 O O58 1 0.34486600 0.94129300 0.52803700 1.0 O O59 1 0.34366400 0.55881100 0.46739600 1.0 O O60 1 0.34280300 0.77200600 0.32033100 1.0 O O61 1 0.34414900 0.73686000 0.68107900 1.0 O O62 1 0.32257400 0.48858000 0.26947400 1.0 O O63 1 0.32260800 0.02100700 0.72647100 1.0 O O64 1 0.17905600 0.98637100 0.22621400 1.0 O O65 1 0.17604100 0.51584100 0.78081600 1.0 O O66 1 0.16207800 0.27032000 0.18025100 1.0 O O67 1 0.15513800 0.23191700 0.82148200 1.0 O O68 1 0.15171700 0.43012800 0.97821300 1.0 O O69 1 0.15669100 0.06141100 0.02831600 1.0 O O70 1 0.14229500 0.33318100 0.58074800 1.0 O O71 1 0.14272500 0.15801700 0.41596800 1.0 O O72 1 0.07570000 0.89566700 0.84181700 1.0 O O73 1 0.07669300 0.60139700 0.15744500 1.0 O O74 1 0.05469600 0.86006000 0.42283600 1.0 O O75 1 0.05347000 0.64690700 0.57561100 1.0