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Sr\n0.700449 0.186498 0.886947 Sr\n0.000042 0.677554 0.002345 Cd\n0.324791 0.322446 0.322488 Cd\n0.999958 0.002303 0.677512 Cd\n0.675209 0.997697 0.997655 Cd\n0.999958 0.322446 0.997655 Cd\n0.675209 0.677554 0.677512 Cd\n0.000042 0.997697 0.322488 Cd\n0.324791 0.002303 0.002345 Cd\n0.738085 0.641794 0.903709 Cd\n0.261915 0.358206 0.096291 Cd\n0.261915 0.165624 0.903709 Cd\n0.738085 0.834376 0.096291 Cd\n0.854649 0.093764 0.760885 Cd\n0.145351 0.906236 0.239115 Cd\n0.332879 0.093764 0.239115 Cd\n0.667121 0.906236 0.760885 Cd\n0.096140 0.244463 0.340603 Cd\n0.903860 0.755537 0.659397 Cd\n0.096140 0.755537 0.851677 Cd\n0.903860 0.244463 0.148323 Cd\n0.595972 0.251254 0.655282 Cd\n0.404028 0.748746 0.344718 Cd\n0.404028 0.059310 0.655282 Cd\n0.595972 0.940690 0.344718 Cd\n0.942485 0.346449 0.596036 Cd\n0.057515 0.653551 0.403964 Cd\n0.750413 0.346449 0.403964 Cd\n0.249587 0.653551 0.596036 Cd\n0.344017 0.403054 0.747071 Cd\n0.655983 0.596946 0.252929 Cd\n0.344017 0.596946 0.940962 Cd\n0.655983 0.403054 0.059038 Cd\n0.587645 0.587645 0.000000 Cd\n0.412355 0.412355 0.000000 Cd\n0.592989 0.000000 0.592989 Cd\n0.407011 0.000000 0.407011 Cd\n0.000000 0.406415 0.406415 Cd\n0.000000 0.593585 0.593585 Cd\n0.777264 0.455016 0.919444 Cd\n0.464428 0.544984 0.322248 Cd\n0.222736 0.142180 0.677752 Cd\n0.535572 0.857820 0.080556 Cd\n0.858810 0.081351 0.540407 Cd\n0.141190 0.681597 0.222541 Cd\n0.540944 0.318403 0.459593 Cd\n0.459056 0.918649 0.777459 Cd\n0.316735 0.458832 0.542038 Cd\n0.916794 0.774697 0.457962 Cd\n0.083206 0.541168 0.857903 Cd\n0.683265 0.225303 0.142097 Cd\n0.222736 0.544984 0.080556 Cd\n0.535572 0.455016 0.677752 Cd\n0.777264 0.857820 0.322248 Cd\n0.464428 0.142180 0.919444 Cd\n0.141190 0.918649 0.459593 Cd\n0.858810 0.318403 0.777459 Cd\n0.459056 0.681597 0.540407 Cd\n0.540944 0.081351 0.222541 Cd\n0.683265 0.541168 0.457962 Cd\n0.083206 0.225303 0.542038 Cd\n0.916794 0.458832 0.142097 Cd\n0.316735 0.774697 0.857903 Cd\n0.500000 0.313139 0.813139 Cd\n0.500000 0.686861 0.186861 Cd\n0.691713 0.191713 0.500000 Cd\n0.308287 0.808287 0.500000 Cd\n0.187312 0.500000 0.687312 Cd\n0.812688 0.500000 0.312688 Cd\n0.913013 0.821888 0.908875 Cd\n0.086987 0.178112 0.091125 Cd\n0.086987 0.995862 0.908875 Cd\n0.913013 0.004138 0.091125 Cd\n","nsites":84,"nelements":2,"elements":["Sr","Cd"],"chemical_system":"Cd-Sr","density":7.143265273565781,"density_atomic":0.03951315768142878,"volume":2125.874137350457,"volume_molar":15.240849158533369,"formula_full":"Sr12 Cd72","formula_reduced":"SrCd6","formula_anonymous":"AB6","energy":-102.99380351,"energy_per_atom":-1.226116708452381,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-102.99380351,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0029434,"is_theoretical":true,"updated_at":"2021-11-28T01:34:59.061000Z","spacegroup":71},{"id":"mp-1043611","created_at":"2022-09-04T14:40:17.376149Z","structure_string":"Zn2 Fe8 O12\n1.0\n1.486300 -5.063060 0.000000\n1.486300 5.063060 0.000000\n0.000000 0.000000 15.396884\nZn Fe O\n2 8 12\ndirect\n0.347392 0.652608 0.750000 Zn\n0.652608 0.347392 0.250000 Zn\n0.134955 0.865045 0.046928 Fe\n0.600107 0.399893 0.636543 Fe\n0.865045 0.134955 0.953072 Fe\n0.399893 0.600107 0.363457 Fe\n0.134955 0.865045 0.453072 Fe\n0.865045 0.134955 0.546928 Fe\n0.399893 0.600107 0.136543 Fe\n0.600107 0.399893 0.863457 Fe\n0.500000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.965100 0.034900 0.836791 O\n0.034900 0.965100 0.163209 O\n0.034900 0.965100 0.336791 O\n0.965100 0.034900 0.663209 O\n0.211942 0.788058 0.917213 O\n0.788058 0.211942 0.082787 O\n0.788058 0.211942 0.417213 O\n0.211942 0.788058 0.582787 O\n0.701894 0.298106 0.750000 O\n0.298106 0.701894 0.250000 O\n","nsites":22,"nelements":3,"elements":["Zn","Fe","O"],"chemical_system":"Fe-O-Zn","density":5.514616208457646,"density_atomic":0.09493804744619895,"volume":231.7300659934819,"volume_molar":6.343232162440169,"formula_full":"Zn2 Fe8 O12","formula_reduced":"Zn(Fe2O3)2","formula_anonymous":"AB4C6","energy":-163.23553599,"energy_per_atom":-7.419797090454545,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-136.94353599,"band_gap":0.6253000000000002,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":36.0000002,"is_theoretical":true,"updated_at":"2021-11-28T01:34:52.708000Z","spacegroup":63}]}