# generated using pymatgen data_Mo5O14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.84076121 _cell_length_b 23.75901648 _cell_length_c 23.75901648 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mo5O14 _chemical_formula_sum 'Mo40 O112' _cell_volume 2168.07461422 _cell_formula_units_Z 8 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 Mo Mo0 1 0.50000000 0.24145194 0.07364817 1.0 Mo Mo1 1 0.50000000 0.92635183 0.24145194 1.0 Mo Mo2 1 0.50000000 0.75854806 0.92635183 1.0 Mo Mo3 1 0.50000000 0.07364817 0.75854806 1.0 Mo Mo4 1 0.50000000 0.25854806 0.57364817 1.0 Mo Mo5 1 0.50000000 0.42635183 0.25854806 1.0 Mo Mo6 1 0.50000000 0.74145194 0.42635183 1.0 Mo Mo7 1 0.50000000 0.57364817 0.74145194 1.0 Mo Mo8 1 0.50000000 0.40122466 0.09877534 1.0 Mo Mo9 1 0.50000000 0.90122466 0.40122466 1.0 Mo Mo10 1 0.50000000 0.59877534 0.90122466 1.0 Mo Mo11 1 0.50000000 0.09877534 0.59877534 1.0 Mo Mo12 1 0.50000000 0.04783258 0.34002228 1.0 Mo Mo13 1 0.50000000 0.65997772 0.04783258 1.0 Mo Mo14 1 0.50000000 0.95216742 0.65997772 1.0 Mo Mo15 1 0.50000000 0.34002228 0.95216742 1.0 Mo Mo16 1 0.50000000 0.45216742 0.84002228 1.0 Mo Mo17 1 0.50000000 0.15997772 0.45216742 1.0 Mo Mo18 1 0.50000000 0.54783258 0.15997772 1.0 Mo Mo19 1 0.50000000 0.84002228 0.54783258 1.0 Mo Mo20 1 0.50000000 0.15745908 0.22060609 1.0 Mo Mo21 1 0.50000000 0.77939391 0.15745908 1.0 Mo Mo22 1 0.50000000 0.84254092 0.77939391 1.0 Mo Mo23 1 0.50000000 0.22060609 0.84254092 1.0 Mo Mo24 1 0.50000000 0.34254092 0.72060609 1.0 Mo Mo25 1 0.50000000 0.27939391 0.34254092 1.0 Mo Mo26 1 0.50000000 0.65745908 0.27939391 1.0 Mo Mo27 1 0.50000000 0.72060609 0.65745908 1.0 Mo Mo28 1 0.50000000 0.29842996 0.20157004 1.0 Mo Mo29 1 0.50000000 0.79842996 0.29842996 1.0 Mo Mo30 1 0.50000000 0.70157004 0.79842996 1.0 Mo Mo31 1 0.50000000 0.20157004 0.70157004 1.0 Mo Mo32 1 0.50000000 0.08330233 0.07732677 1.0 Mo Mo33 1 0.50000000 0.92267323 0.08330233 1.0 Mo Mo34 1 0.50000000 0.91669767 0.92267323 1.0 Mo Mo35 1 0.50000000 0.07732677 0.91669767 1.0 Mo Mo36 1 0.50000000 0.41669767 0.57732677 1.0 Mo Mo37 1 0.50000000 0.42267323 0.41669767 1.0 Mo Mo38 1 0.50000000 0.58330233 0.42267323 1.0 Mo Mo39 1 0.50000000 0.57732677 0.58330233 1.0 O O40 1 0.50000000 0.22416127 0.16162525 1.0 O O41 1 0.50000000 0.83837475 0.22416127 1.0 O O42 1 0.50000000 0.77583873 0.83837475 1.0 O O43 1 0.50000000 0.16162525 0.77583873 1.0 O O44 1 0.50000000 0.27583873 0.66162525 1.0 O O45 1 0.50000000 0.33837475 0.27583873 1.0 O O46 1 0.50000000 0.72416127 0.33837475 1.0 O O47 1 0.50000000 0.66162525 0.72416127 1.0 O O48 1 0.00000000 0.04623984 0.33762387 1.0 O O49 1 -0.00000000 0.66237613 0.04623984 1.0 O O50 1 -0.00000000 0.95376016 0.66237613 1.0 O O51 1 0.00000000 0.33762387 0.95376016 1.0 O O52 1 -0.00000000 0.45376016 0.83762387 1.0 O O53 1 -0.00000000 0.16237613 0.45376016 1.0 O O54 1 0.00000000 0.54623984 0.16237613 1.0 O O55 1 0.00000000 0.83762387 0.54623984 1.0 O O56 1 0.50000000 0.16642707 0.06143165 1.0 O O57 1 0.50000000 0.93856835 0.16642707 1.0 O O58 1 0.50000000 0.83357293 0.93856835 1.0 O O59 1 0.50000000 0.06143165 0.83357293 1.0 O O60 1 0.50000000 0.33357293 0.56143165 1.0 O O61 1 0.50000000 0.43856835 0.33357293 1.0 O O62 1 0.50000000 0.66642707 0.43856835 1.0 O O63 1 0.50000000 0.56143165 0.66642707 1.0 O O64 1 0.50000000 0.11257957 0.28301162 1.0 O O65 1 0.50000000 0.71698838 0.11257957 1.0 O O66 1 0.50000000 0.88742043 0.71698838 1.0 O O67 1 0.50000000 0.28301162 0.88742043 1.0 O O68 1 0.50000000 0.38742043 0.78301162 1.0 O O69 1 0.50000000 0.21698838 0.38742043 1.0 O O70 1 0.50000000 0.61257957 0.21698838 1.0 O O71 1 0.50000000 0.78301162 0.61257957 1.0 O O72 1 -0.00000000 0.29882217 0.20117783 1.0 O O73 1 -0.00000000 0.79882217 0.29882217 1.0 O O74 1 0.00000000 0.70117783 0.79882217 1.0 O O75 1 0.00000000 0.20117783 0.70117783 1.0 O O76 1 -0.00000000 0.08711710 0.07959917 1.0 O O77 1 -0.00000000 0.92040083 0.08711710 1.0 O O78 1 0.00000000 0.91288290 0.92040083 1.0 O O79 1 0.00000000 0.07959917 0.91288290 1.0 O O80 1 0.00000000 0.41288290 0.57959917 1.0 O O81 1 -0.00000000 0.42040083 0.41288290 1.0 O O82 1 -0.00000000 0.58711710 0.42040083 1.0 O O83 1 0.00000000 0.57959917 0.58711710 1.0 O O84 1 0.50000000 0.38902652 0.02239623 1.0 O O85 1 0.50000000 0.97760377 0.38902652 1.0 O O86 1 0.50000000 0.61097348 0.97760377 1.0 O O87 1 0.50000000 0.02239623 0.61097348 1.0 O O88 1 0.50000000 0.11097348 0.52239623 1.0 O O89 1 0.50000000 0.47760377 0.11097348 1.0 O O90 1 0.50000000 0.88902652 0.47760377 1.0 O O91 1 0.50000000 0.52239623 0.88902652 1.0 O O92 1 0.50000000 0.27239319 0.00371104 1.0 O O93 1 0.50000000 0.99628896 0.27239319 1.0 O O94 1 0.50000000 0.72760681 0.99628896 1.0 O O95 1 0.50000000 0.00371104 0.72760681 1.0 O O96 1 0.50000000 0.22760681 0.50371104 1.0 O O97 1 0.50000000 0.49628896 0.22760681 1.0 O O98 1 0.50000000 0.77239319 0.49628896 1.0 O O99 1 0.50000000 0.50371104 0.77239319 1.0 O O100 1 0.50000000 0.31528313 0.11555988 1.0 O O101 1 0.50000000 0.88444012 0.31528313 1.0 O O102 1 0.50000000 0.68471687 0.88444012 1.0 O O103 1 0.50000000 0.11555988 0.68471687 1.0 O O104 1 0.50000000 0.18471687 0.61555988 1.0 O O105 1 0.50000000 0.38444012 0.18471687 1.0 O O106 1 0.50000000 0.81528313 0.38444012 1.0 O O107 1 0.50000000 0.61555988 0.81528313 1.0 O O108 1 0.00000000 0.39787286 0.10212714 1.0 O O109 1 0.00000000 0.89787286 0.39787286 1.0 O O110 1 -0.00000000 0.60212714 0.89787286 1.0 O O111 1 -0.00000000 0.10212714 0.60212714 1.0 O O112 1 0.50000000 0.10715426 0.16147127 1.0 O O113 1 0.50000000 0.83852873 0.10715426 1.0 O O114 1 0.50000000 0.89284574 0.83852873 1.0 O O115 1 0.50000000 0.16147127 0.89284574 1.0 O O116 1 0.50000000 0.39284574 0.66147127 1.0 O O117 1 0.50000000 0.33852873 0.39284574 1.0 O O118 1 0.50000000 0.60715426 0.33852873 1.0 O O119 1 0.50000000 0.66147127 0.60715426 1.0 O O120 1 0.50000000 0.00508139 0.08138230 1.0 O O121 1 0.50000000 0.91861770 0.00508139 1.0 O O122 1 0.50000000 0.99491861 0.91861770 1.0 O O123 1 0.50000000 0.08138230 0.99491861 1.0 O O124 1 0.50000000 0.49491861 0.58138230 1.0 O O125 1 0.50000000 0.41861770 0.49491861 1.0 O O126 1 0.50000000 0.50508139 0.41861770 1.0 O O127 1 0.50000000 0.58138230 0.50508139 1.0 O O128 1 -0.00000000 0.24416218 0.07806690 1.0 O O129 1 -0.00000000 0.92193310 0.24416218 1.0 O O130 1 0.00000000 0.75583782 0.92193310 1.0 O O131 1 0.00000000 0.07806690 0.75583782 1.0 O O132 1 0.00000000 0.25583782 0.57806690 1.0 O O133 1 -0.00000000 0.42193310 0.25583782 1.0 O O134 1 -0.00000000 0.74416218 0.42193310 1.0 O O135 1 0.00000000 0.57806690 0.74416218 1.0 O O136 1 0.50000000 0.23576074 0.26423926 1.0 O O137 1 0.50000000 0.73576074 0.23576074 1.0 O O138 1 0.50000000 0.76423926 0.73576074 1.0 O O139 1 0.50000000 0.26423926 0.76423926 1.0 O O140 1 0.50000000 0.09776673 0.40223327 1.0 O O141 1 0.50000000 0.59776673 0.09776673 1.0 O O142 1 0.50000000 0.90223327 0.59776673 1.0 O O143 1 0.50000000 0.40223327 0.90223327 1.0 O O144 1 -0.00000000 0.16370442 0.22048023 1.0 O O145 1 -0.00000000 0.77951977 0.16370442 1.0 O O146 1 0.00000000 0.83629558 0.77951977 1.0 O O147 1 0.00000000 0.22048023 0.83629558 1.0 O O148 1 0.00000000 0.33629558 0.72048023 1.0 O O149 1 -0.00000000 0.27951977 0.33629558 1.0 O O150 1 -0.00000000 0.66370442 0.27951977 1.0 O O151 1 0.00000000 0.72048023 0.66370442 1.0