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0.109238 0.962001 O\n0.850203 0.609231 0.961990 O\n0.643482 0.905245 0.037466 F\n0.143276 0.405207 0.037546 F\n0.893541 0.155327 0.537468 F\n0.393874 0.655278 0.537300 F\n0.114879 0.862390 0.130907 F\n0.614891 0.362402 0.130882 F\n0.366708 0.111819 0.631152 F\n0.866711 0.611824 0.631155 F\n0.605072 0.877410 0.357910 F\n0.105086 0.377403 0.357900 F\n0.855075 0.127415 0.857915 F\n0.355069 0.627411 0.857903 F\n","nsites":56,"nelements":4,"elements":["Li","Mn","O","F"],"chemical_system":"F-Li-Mn-O","density":2.4854763579523853,"density_atomic":0.10049491266361797,"volume":557.2421380915692,"volume_molar":5.992483201769264,"formula_full":"Li28 Mn4 O12 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O\n","nsites":6,"nelements":2,"elements":["C","O"],"chemical_system":"C-O","density":3.108850246760382,"density_atomic":0.127621993848294,"volume":47.01384000576171,"volume_molar":4.718732703046937,"formula_full":"C2 O4","formula_reduced":"CO2","formula_anonymous":"AB2","energy":-46.16846275,"energy_per_atom":-7.694743791666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-43.42046275,"band_gap":7.441800000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:36:26.037000Z","spacegroup":122},{"id":"mp-29745","created_at":"2022-09-04T14:45:59.467371Z","structure_string":"Na8 Mn8 Se12\n1.0\n7.006694 7.827988 0.000000\n-7.006694 7.827988 0.000000\n0.000000 3.379260 6.486128\nNa Mn Se\n8 8 12\ndirect\n0.019900 0.189566 0.360969 Na\n0.810434 0.980100 0.139031 Na\n0.980100 0.810434 0.639031 Na\n0.189566 0.019900 0.860969 Na\n0.720918 0.279082 0.250000 Na\n0.279082 0.720918 0.750000 Na\n0.430117 0.569883 0.250000 Na\n0.569883 0.430117 0.750000 Na\n0.446699 0.919392 0.241944 Mn\n0.080608 0.553301 0.258056 Mn\n0.553301 0.080608 0.758056 Mn\n0.919392 0.446699 0.741944 Mn\n0.634083 0.786313 0.703613 Mn\n0.213687 0.365917 0.796387 Mn\n0.365917 0.213687 0.296387 Mn\n0.786313 0.634083 0.203613 Mn\n0.227188 0.997524 0.452609 Se\n0.002476 0.772812 0.047391 Se\n0.772812 0.002476 0.547391 Se\n0.997524 0.227188 0.952609 Se\n0.853438 0.415834 0.450265 Se\n0.584166 0.146562 0.049735 Se\n0.146562 0.584166 0.549735 Se\n0.415834 0.853438 0.950265 Se\n0.571213 0.721849 0.433556 Se\n0.278151 0.428787 0.066444 Se\n0.428787 0.278151 0.566444 Se\n0.721849 0.571213 0.933556 Se\n","nsites":28,"nelements":3,"elements":["Na","Mn","Se"],"chemical_system":"Mn-Na-Se","density":3.666321769599471,"density_atomic":0.03935312438954357,"volume":711.5064034773264,"volume_molar":15.30282754779219,"formula_full":"Na8 Mn8 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