# generated using pymatgen data_LiCr6O11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.82114126 _cell_length_b 5.82114126 _cell_length_c 12.93740700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999162 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCr6O11 _chemical_formula_sum 'Li2 Cr12 O22' _cell_volume 379.65942559 _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 0.33333300 0.66666700 0.25935400 1.0 Li Li1 1 0.66666700 0.33333300 0.75935400 1.0 Cr Cr2 1 0.99890100 0.49945100 0.99935000 1.0 Cr Cr3 1 0.33333300 0.66666700 0.74937100 1.0 Cr Cr4 1 0.00000000 0.00000000 0.14482300 1.0 Cr Cr5 1 0.00000000 0.00000000 0.35388100 1.0 Cr Cr6 1 0.00000000 0.00000000 0.64482300 1.0 Cr Cr7 1 0.00000000 0.00000000 0.85388100 1.0 Cr Cr8 1 0.50054900 0.00109900 0.99935000 1.0 Cr Cr9 1 0.50054900 0.49945100 0.99935000 1.0 Cr Cr10 1 0.49945100 0.50054900 0.49935000 1.0 Cr Cr11 1 0.66666700 0.33333300 0.24937100 1.0 Cr Cr12 1 0.49945100 0.99890100 0.49935000 1.0 Cr Cr13 1 0.00109900 0.50054900 0.49935000 1.0 O O14 1 0.15236000 0.84764000 0.74922300 1.0 O O15 1 0.17471900 0.82528100 0.42021100 1.0 O O16 1 0.17409000 0.82591000 0.07772600 1.0 O O17 1 0.33333300 0.66666700 0.58685200 1.0 O O18 1 0.33333300 0.66666700 0.91202300 1.0 O O19 1 0.17471900 0.34943700 0.42021100 1.0 O O20 1 0.15236000 0.30472100 0.74922300 1.0 O O21 1 0.17409000 0.34818100 0.07772600 1.0 O O22 1 0.30472100 0.15236000 0.24922300 1.0 O O23 1 0.65181900 0.82591000 0.07772600 1.0 O O24 1 0.65056300 0.82528100 0.42021100 1.0 O O25 1 0.34943700 0.17471900 0.92021100 1.0 O O26 1 0.34818100 0.17409000 0.57772600 1.0 O O27 1 0.69527900 0.84764000 0.74922300 1.0 O O28 1 0.82528100 0.65056300 0.92021100 1.0 O O29 1 0.66666700 0.33333300 0.08685200 1.0 O O30 1 0.66666700 0.33333300 0.41202300 1.0 O O31 1 0.84764000 0.69527900 0.24922300 1.0 O O32 1 0.82591000 0.65181900 0.57772600 1.0 O O33 1 0.82591000 0.17409000 0.57772600 1.0 O O34 1 0.82528100 0.17471900 0.92021100 1.0 O O35 1 0.84764000 0.15236000 0.24922300 1.0