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0.855145 O\n0.941733 0.407846 0.358985 O\n0.946459 0.402767 0.864479 O\n0.945266 0.898791 0.355910 O\n0.949371 0.892995 0.858289 O\n0.341562 0.284606 0.138153 O\n0.333468 0.289902 0.639177 O\n0.340959 0.789076 0.141872 O\n0.331025 0.796531 0.632580 O\n0.840051 0.287866 0.141447 O\n0.831376 0.300948 0.646794 O\n0.838169 0.782131 0.136936 O\n0.828109 0.792757 0.638400 O\n0.194067 0.204318 0.358785 O\n0.194079 0.209588 0.865000 O\n0.199769 0.706046 0.364958 O\n0.204183 0.714811 0.861448 O\n0.686048 0.209070 0.353352 O\n0.688465 0.211881 0.859672 O\n0.698834 0.703921 0.357529 O\n0.705991 0.718691 0.864801 O\n0.421594 0.066101 0.248904 O\n0.421645 0.063880 0.743447 O\n0.422680 0.569410 0.248442 O\n0.431960 0.574244 0.757929 O\n0.924311 0.059821 0.239988 O\n0.933529 0.059142 0.750640 O\n0.924286 0.570846 0.249259 O\n0.934434 0.575503 0.761035 O\n0.173021 0.432557 0.240276 O\n0.182828 0.440944 0.751062 O\n0.171915 0.925182 0.248902 O\n0.188016 0.933890 0.760135 O\n0.670778 0.427582 0.247460 O\n0.678645 0.442221 0.760372 O\n0.675258 0.931287 0.240199 O\n0.674692 0.929589 0.752038 O\n","nsites":144,"nelements":5,"elements":["Sr","Ca","Fe","Co","O"],"chemical_system":"Ca-Co-Fe-O-Sr","density":4.371310449721405,"density_atomic":0.07647187108027019,"volume":1883.0453337390893,"volume_molar":7.874975039748593,"formula_full":"Sr12 Ca20 Fe20 Co12 O80","formula_reduced":"Sr3Ca5Fe5Co3O20","formula_anonymous":"A3B3C5D5E20","energy":-1039.8430792,"energy_per_atom":-7.2211324944444435,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-920.1070792,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":133.9277412,"is_theoretical":true,"updated_at":"2021-11-28T01:37:17.269000Z","spacegroup":1},{"id":"mp-1210257","created_at":"2022-09-04T14:46:08.316598Z","structure_string":"Na6 Ti2 F12\n1.0\n5.873706 0.000000 0.000000\n0.000000 5.726021 0.000000\n0.000000 5.618267 8.102246\nNa Ti F\n6 2 12\ndirect\n0.500000 0.500000 0.000000 Na\n0.000000 0.500000 0.500000 Na\n0.051007 0.734781 0.752163 Na\n0.948993 0.265219 0.247837 Na\n0.551007 0.265219 0.747837 Na\n0.448993 0.734781 0.252163 Na\n0.500000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.783972 0.755462 0.567624 F\n0.216028 0.244538 0.432376 F\n0.283972 0.244538 0.932376 F\n0.716028 0.755462 0.067624 F\n0.452524 0.884171 0.728953 F\n0.547476 0.115829 0.271047 F\n0.952524 0.115829 0.771047 F\n0.047476 0.884171 0.228953 F\n0.321071 0.665824 0.545722 F\n0.678929 0.334176 0.454278 F\n0.821071 0.334176 0.954278 F\n0.178929 0.665824 0.045722 F\n","nsites":20,"nelements":3,"elements":["Na","Ti","F"],"chemical_system":"F-Na-Ti","density":2.813161210581648,"density_atomic":0.07339380934692831,"volume":272.5025472579186,"volume_molar":8.205243485228689,"formula_full":"Na6 Ti2 F12","formula_reduced":"Na3TiF6","formula_anonymous":"AB3C6","energy":-111.93357094,"energy_per_atom":-5.596678547,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-106.38957094,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0012826,"is_theoretical":true,"updated_at":"2021-11-28T01:37:26.798000Z","spacegroup":14}]}