# generated using pymatgen data_Li2CrCo3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.12669661 _cell_length_b 8.12669661 _cell_length_c 8.14302690 _cell_angle_alpha 89.92239976 _cell_angle_beta 89.92239976 _cell_angle_gamma 89.86013165 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2CrCo3O8 _chemical_formula_sum 'Li8 Cr4 Co12 O32' _cell_volume 537.78894952 _cell_formula_units_Z 4 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 0.99992500 0.25162000 0.87496500 1.0 Li Li1 1 0.74838000 0.00007500 0.12503500 1.0 Li Li2 1 0.25176300 0.99918800 0.62459700 1.0 Li Li3 1 0.00081200 0.74823700 0.37540300 1.0 Li Li4 1 0.50067700 0.74870300 0.87761200 1.0 Li Li5 1 0.75051600 0.49556300 0.62435000 1.0 Li Li6 1 0.25129700 0.49932300 0.12238800 1.0 Li Li7 1 0.50443700 0.24948400 0.37565000 1.0 Cr Cr8 1 0.12589300 0.12448800 0.25296400 1.0 Cr Cr9 1 0.87551200 0.87410700 0.74703600 1.0 Cr Cr10 1 0.37907200 0.62092800 0.50000000 1.0 Cr Cr11 1 0.62459100 0.37540900 0.00000000 1.0 Co Co12 1 0.87428500 0.12571500 0.50000000 1.0 Co Co13 1 0.62221100 0.12396200 0.74739500 1.0 Co Co14 1 0.37462100 0.12298100 0.99722800 1.0 Co Co15 1 0.62353600 0.87365800 0.49895000 1.0 Co Co16 1 0.37692500 0.87305200 0.24942500 1.0 Co Co17 1 0.12751400 0.87248600 0.00000000 1.0 Co Co18 1 0.62758600 0.62607100 0.24945100 1.0 Co Co19 1 0.87701900 0.62537900 0.00277200 1.0 Co Co20 1 0.12694800 0.62307500 0.75057500 1.0 Co Co21 1 0.87603800 0.37778900 0.25260500 1.0 Co Co22 1 0.12634200 0.37646400 0.50105000 1.0 Co Co23 1 0.37392900 0.37241400 0.75054900 1.0 O O24 1 0.88821200 0.13945000 0.26563500 1.0 O O25 1 0.11062700 0.13751000 0.49106400 1.0 O O26 1 0.38782100 0.13602300 0.76406400 1.0 O O27 1 0.86055000 0.11178800 0.73436500 1.0 O O28 1 0.60558700 0.12523700 0.97980800 1.0 O O29 1 0.63884600 0.11009800 0.51688500 1.0 O O30 1 0.36152400 0.11290600 0.23212300 1.0 O O31 1 0.14154200 0.10618500 0.00764000 1.0 O O32 1 0.86249000 0.88937300 0.50893600 1.0 O O33 1 0.63616100 0.89052300 0.73911100 1.0 O O34 1 0.36036200 0.88922100 0.01176600 1.0 O O35 1 0.38567800 0.85951300 0.48357400 1.0 O O36 1 0.13464200 0.88560000 0.23111800 1.0 O O37 1 0.61029400 0.86031800 0.26582200 1.0 O O38 1 0.89381500 0.85845800 0.99236000 1.0 O O39 1 0.11440000 0.86535800 0.76888200 1.0 O O40 1 0.61123100 0.63560000 0.48689800 1.0 O O41 1 0.39075600 0.63844600 0.25871900 1.0 O O42 1 0.11077900 0.63963800 0.98823400 1.0 O O43 1 0.64239700 0.61711900 0.01479900 1.0 O O44 1 0.88709400 0.63847600 0.76787700 1.0 O O45 1 0.86397700 0.61217900 0.23593600 1.0 O O46 1 0.14048700 0.61432200 0.51642600 1.0 O O47 1 0.36155400 0.60924400 0.74128100 1.0 O O48 1 0.64451300 0.38759600 0.24437400 1.0 O O49 1 0.87476300 0.39441300 0.02019200 1.0 O O50 1 0.13968200 0.38970600 0.73417800 1.0 O O51 1 0.10947700 0.36383900 0.26088900 1.0 O O52 1 0.36440000 0.38876900 0.51310200 1.0 O O53 1 0.88990200 0.36115400 0.48311500 1.0 O O54 1 0.61240400 0.35548700 0.75562600 1.0 O O55 1 0.38288100 0.35760300 0.98520100 1.0