# generated using pymatgen data_Li4Cr3NiO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.12237100 _cell_length_b 7.80230236 _cell_length_c 7.81112739 _cell_angle_alpha 94.13700340 _cell_angle_beta 108.98043342 _cell_angle_gamma 96.30708318 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Cr3NiO8 _chemical_formula_sum 'Li8 Cr6 Ni2 O16' _cell_volume 291.48269232 _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 0.87384300 0.62764500 0.87246100 1.0 Li Li1 1 0.62283100 0.86865100 0.62304000 1.0 Li Li2 1 0.74837500 0.24762000 0.74586600 1.0 Li Li3 1 0.25162500 0.75238000 0.25413400 1.0 Li Li4 1 0.37716900 0.13134900 0.37696000 1.0 Li Li5 1 0.50000000 0.50000000 0.50000000 1.0 Li Li6 1 0.00000000 0.00000000 0.00000000 1.0 Li Li7 1 0.12615700 0.37235500 0.12753900 1.0 Cr Cr8 1 0.18743800 0.06238500 0.68589300 1.0 Cr Cr9 1 0.31014100 0.43813600 0.80727300 1.0 Cr Cr10 1 0.81256200 0.93761500 0.31410700 1.0 Cr Cr11 1 0.43736600 0.81147300 0.93586200 1.0 Cr Cr12 1 0.56263400 0.18852700 0.06413800 1.0 Cr Cr13 1 0.68985900 0.56186400 0.19272700 1.0 Ni Ni14 1 0.06315900 0.68914600 0.56296500 1.0 Ni Ni15 1 0.93684100 0.31085400 0.43703500 1.0 O O16 1 0.46433300 0.65354100 0.72867900 1.0 O O17 1 0.05354100 0.84622000 0.78107600 1.0 O O18 1 0.57407700 0.02976700 0.84899200 1.0 O O19 1 0.66011300 0.71946500 0.39488100 1.0 O O20 1 0.19884800 0.90791200 0.47061600 1.0 O O21 1 0.33988700 0.28053500 0.60511900 1.0 O O22 1 0.80115200 0.09208800 0.52938400 1.0 O O23 1 0.82408300 0.77935300 0.10006500 1.0 O O24 1 0.94645900 0.15378000 0.21892400 1.0 O O25 1 0.93360200 0.46935600 0.65567100 1.0 O O26 1 0.42592300 0.97023300 0.15100800 1.0 O O27 1 0.06639800 0.53064400 0.34432900 1.0 O O28 1 0.53566700 0.34645900 0.27132100 1.0 O O29 1 0.69529600 0.40635700 0.97510000 1.0 O O30 1 0.17591700 0.22064700 0.89993500 1.0 O O31 1 0.30470400 0.59364300 0.02490000 1.0