# generated using pymatgen data_Li2Mo4O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.34863700 _cell_length_b 8.74569020 _cell_length_c 11.88847051 _cell_angle_alpha 110.82277643 _cell_angle_beta 94.33942232 _cell_angle_gamma 96.34139199 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Mo4O13 _chemical_formula_sum 'Li6 Mo12 O39' _cell_volume 800.17676918 _cell_formula_units_Z 3 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 0.69196400 0.28567200 0.37506100 1.0 Li Li1 1 0.30803600 0.71432800 0.62493900 1.0 Li Li2 1 0.70727200 0.49830400 0.98974700 1.0 Li Li3 1 0.29272800 0.50169600 0.01025300 1.0 Li Li4 1 0.89563200 0.75132000 0.62982100 1.0 Li Li5 1 0.10436800 0.24868000 0.37017900 1.0 Mo Mo6 1 0.02968300 0.76335800 0.03721500 1.0 Mo Mo7 1 0.97031700 0.23664200 0.96278500 1.0 Mo Mo8 1 0.63275800 0.78321800 0.03581300 1.0 Mo Mo9 1 0.36724200 0.21678200 0.96418700 1.0 Mo Mo10 1 0.77406400 0.94632900 0.36509900 1.0 Mo Mo11 1 0.22593600 0.05367100 0.63490100 1.0 Mo Mo12 1 0.37749600 0.97210200 0.36178400 1.0 Mo Mo13 1 0.62250400 0.02789800 0.63821600 1.0 Mo Mo14 1 0.58273100 0.39727200 0.63756400 1.0 Mo Mo15 1 0.41726900 0.60272800 0.36243600 1.0 Mo Mo16 1 0.97290100 0.38141900 0.63622600 1.0 Mo Mo17 1 0.02709900 0.61858100 0.36377400 1.0 O O18 1 0.93565800 0.46792100 0.80530400 1.0 O O19 1 0.06434200 0.53207900 0.19469600 1.0 O O20 1 0.98107100 0.12696900 0.79043700 1.0 O O21 1 0.01892900 0.87303100 0.20956300 1.0 O O22 1 0.88962500 0.43340600 0.38017100 1.0 O O23 1 0.11037500 0.56659400 0.61982900 1.0 O O24 1 0.50000000 0.00000000 0.00000000 1.0 O O25 1 0.49192100 0.68172300 0.99719200 1.0 O O26 1 0.50807900 0.31827700 0.00280800 1.0 O O27 1 0.40308700 0.95869200 0.61564100 1.0 O O28 1 0.59691300 0.04130800 0.38435900 1.0 O O29 1 0.43921900 0.26375100 0.60233200 1.0 O O30 1 0.56078100 0.73624900 0.39766800 1.0 O O31 1 0.45292400 0.61938200 0.58218200 1.0 O O32 1 0.54707600 0.38061800 0.41781800 1.0 O O33 1 0.39409700 0.82160400 0.20710000 1.0 O O34 1 0.60590300 0.17839600 0.79290000 1.0 O O35 1 0.34083800 0.21127400 0.20576000 1.0 O O36 1 0.65916200 0.78872600 0.79424000 1.0 O O37 1 0.34598400 0.44765200 0.80747200 1.0 O O38 1 0.65401600 0.55234800 0.19252800 1.0 O O39 1 0.24040000 0.83997900 0.78904100 1.0 O O40 1 0.75960000 0.16002100 0.21095900 1.0 O O41 1 0.21478400 0.42332200 0.40771300 1.0 O O42 1 0.78521600 0.57667800 0.59228700 1.0 O O43 1 0.25891900 0.73287800 0.38984200 1.0 O O44 1 0.74108100 0.26712200 0.61015800 1.0 O O45 1 0.26633800 0.03430700 0.41301100 1.0 O O46 1 0.73366200 0.96569300 0.58698900 1.0 O O47 1 0.15174500 0.01693100 0.99084900 1.0 O O48 1 0.84825500 0.98306900 0.00915100 1.0 O O49 1 0.18921500 0.29446000 0.99410100 1.0 O O50 1 0.81078500 0.70554000 0.00589900 1.0 O O51 1 0.13695300 0.67575600 0.99788200 1.0 O O52 1 0.86304700 0.32424400 0.00211800 1.0 O O53 1 0.08350100 0.95139800 0.59723100 1.0 O O54 1 0.91649900 0.04860200 0.40276900 1.0 O O55 1 0.08720200 0.29757300 0.58326600 1.0 O O56 1 0.91279800 0.70242700 0.41673400 1.0