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            "structure_string": "Mg1 Fe6 Sb10 I6 O18\n1.0\n-7.705177 -0.017179 -2.539114\n0.485048 -0.118145 -9.406177\n-0.211737 -12.173142 -2.909334\nMg Fe Sb I O\n1 6 10 6 18\ndirect\n0.895421 0.582515 0.757982 Mg\n0.720808 0.962822 0.348177 Fe\n0.299257 0.004996 0.644371 Fe\n0.024117 0.959192 0.124761 Fe\n0.978674 0.065027 0.864200 Fe\n0.622715 0.086254 0.061719 Fe\n0.392941 0.933068 0.944870 Fe\n0.884804 0.125073 0.518933 Sb\n0.118272 0.786337 0.506392 Sb\n0.256270 0.138331 0.262330 Sb\n0.729493 0.894295 0.718918 Sb\n0.529231 0.238482 0.757943 Sb\n0.456776 0.790690 0.242983 Sb\n0.207825 0.267295 0.987779 Sb\n0.796558 0.750283 0.010464 Sb\n0.816843 0.287418 0.213230 Sb\n0.202667 0.697382 0.808518 Sb\n0.710244 0.416711 0.928672 I\n0.265474 0.664963 0.067133 I\n0.882174 0.672874 0.306919 I\n0.086229 0.317964 0.679400 I\n0.509005 0.254526 0.423981 I\n0.499362 0.722027 0.581598 I\n0.153126 0.071057 0.978541 O\n0.859711 0.945836 0.011173 O\n0.868017 0.926111 0.478283 O\n0.137688 0.987011 0.537709 O\n0.788537 0.090758 0.188550 O\n0.180960 0.916121 0.793194 O\n0.445901 0.157789 0.912544 O\n0.549427 0.874058 0.091811 O\n0.764362 0.129087 0.785853 O\n0.215728 0.943486 0.226997 O\n0.490881 0.052950 0.706062 O\n0.495899 0.958610 0.300786 O\n0.054877 0.249694 0.140019 O\n0.961518 0.696358 0.865637 O\n0.070344 0.697056 0.666146 O\n0.947374 0.183824 0.349752 O\n0.633856 0.849523 0.886856 O\n0.379449 0.195003 0.110480 O\n",
            "nsites": 41,
            "nelements": 5,
            "elements": [
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                "Fe",
                "Sb",
                "I",
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            "chemical_system": "Fe-I-Mg-O-Sb",
            "density": 4.8749863074920174,
            "density_atomic": 0.04582988575837941,
            "volume": 894.6127471527392,
            "volume_molar": 13.140204607424597,
            "formula_full": "Mg1 Fe6 Sb10 I6 O18",
            "formula_reduced": "MgFe6Sb10(IO3)6",
            "formula_anonymous": "AB6C6D10E18",
            "energy": -250.48804183,
            "energy_per_atom": -6.109464434878048,
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            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -222.31204183,
            "band_gap": 0.7198000000000002,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 24.0000001,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:51.857000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1202728",
            "created_at": "2022-09-04T14:42:39.676747Z",
            "structure_string": "K4 Zr2 Si6 O22\n1.0\n4.101317 -5.390087 0.000000\n4.101317 5.390087 0.000000\n0.000000 0.000000 12.105968\nK Zr Si O\n4 2 6 22\ndirect\n0.527679 0.125222 0.549912 K\n0.125222 0.527679 0.450088 K\n0.472321 0.874778 0.049912 K\n0.874778 0.472321 0.950088 K\n0.407537 0.592463 0.750000 Zr\n0.592463 0.407537 0.250000 Zr\n0.673221 0.673221 0.500000 Si\n0.326779 0.326779 0.000000 Si\n0.289609 0.065475 0.791125 Si\n0.065475 0.289609 0.208875 Si\n0.710391 0.934525 0.291125 Si\n0.934525 0.710391 0.708875 Si\n0.474791 0.652200 0.578730 O\n0.652200 0.474791 0.421270 O\n0.525209 0.347800 0.078730 O\n0.347800 0.525209 0.921270 O\n0.366457 0.277918 0.723456 O\n0.277918 0.366457 0.276544 O\n0.633543 0.722082 0.223456 O\n0.722082 0.633543 0.776544 O\n0.288974 0.114512 0.925374 O\n0.114512 0.288974 0.074626 O\n0.711026 0.885488 0.425374 O\n0.885488 0.711026 0.574626 O\n0.433841 0.910342 0.774277 O\n0.910342 0.433841 0.225723 O\n0.566159 0.089658 0.274277 O\n0.089658 0.566159 0.725723 O\n0.052968 0.947032 0.750000 O\n0.947032 0.052968 0.250000 O\n0.793274 0.050310 0.902606 O\n0.050310 0.793274 0.097394 O\n0.206726 0.949690 0.402606 O\n0.949690 0.206726 0.597394 O\n",
            "nsites": 34,
            "nelements": 4,
            "elements": [
                "K",
                "Zr",
                "Si",
                "O"
            ],
            "chemical_system": "K-O-Si-Zr",
            "density": 2.666035940864575,
            "density_atomic": 0.06352289559444167,
            "volume": 535.2400844109984,
            "volume_molar": 9.480268025639159,
            "formula_full": "K4 Zr2 Si6 O22",
            "formula_reduced": "K2ZrSi3O11",
            "formula_anonymous": "AB2C3D11",
            "energy": -251.06159262,
            "energy_per_atom": -7.384164488823529,
            "energy_above_hull": null,
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            "decomposes_to": null,
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            "formation_energy_per_atom": null,
            "energy_uncorrected": -235.94759262,
            "band_gap": 0.4676,
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            "is_magnetic": true,
            "total_magnetization": 8.0005939,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:05.371000Z",
            "spacegroup": 20
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        {
            "id": "mp-556229",
            "created_at": "2022-09-04T14:42:39.679368Z",
            "structure_string": "Li4 Mn2 F10\n1.0\n2.527425 5.108281 0.000000\n-2.527425 5.108281 0.000000\n0.000000 2.834923 6.960033\nLi Mn F\n4 2 10\ndirect\n0.628876 0.642962 0.754509 Li\n0.642962 0.628876 0.254509 Li\n0.371124 0.357038 0.245491 Li\n0.357038 0.371124 0.745491 Li\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.215501 0.784499 0.250000 F\n0.784499 0.215501 0.750000 F\n0.776691 0.395921 0.044733 F\n0.604079 0.223309 0.455267 F\n0.223309 0.604079 0.955267 F\n0.395921 0.776691 0.544733 F\n0.328498 0.026997 0.852354 F\n0.973003 0.671502 0.647646 F\n0.671502 0.973003 0.147646 F\n0.026997 0.328498 0.352354 F\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Li",
                "Mn",
                "F"
            ],
            "chemical_system": "F-Li-Mn",
            "density": 3.027126827041776,
            "density_atomic": 0.08902779805507763,
            "volume": 179.719147834045,
            "volume_molar": 6.764337534524176,
            "formula_full": "Li4 Mn2 F10",
            "formula_reduced": "Li2MnF5",
            "formula_anonymous": "AB2C5",
            "energy": -93.04616956,
            "energy_per_atom": -5.8153855975,
            "energy_above_hull": null,
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            "decomposes_to": null,
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            "formation_energy_per_atom": null,
            "energy_uncorrected": -85.09016956,
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            "is_magnetic": true,
            "total_magnetization": 7.9988929,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:50.540000Z",
            "spacegroup": 15
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        {
            "id": "mp-23294",
            "created_at": "2022-09-04T14:42:39.174011Z",
            "structure_string": "Ru4 Br12\n1.0\n5.925980 0.000000 0.000000\n0.000000 7.141663 0.000000\n0.000000 0.000000 12.413004\nRu Br\n4 12\ndirect\n0.749742 0.254000 0.500000 Ru\n0.249742 0.746000 0.000000 Ru\n0.250258 0.254000 0.500000 Ru\n0.750258 0.746000 0.000000 Ru\n0.000000 0.969473 0.500000 Br\n0.500000 0.030527 0.000000 Br\n0.500000 0.538850 0.500000 Br\n0.000000 0.461150 0.000000 Br\n0.000000 0.396565 0.358405 Br\n0.500000 0.603435 0.141595 Br\n0.000000 0.396565 0.641595 Br\n0.500000 0.603435 0.858405 Br\n0.000000 0.888752 0.141859 Br\n0.500000 0.111248 0.358141 Br\n0.000000 0.888752 0.858141 Br\n0.500000 0.111248 0.641859 Br\n",
            "nsites": 16,
            "nelements": 2,
            "elements": [
                "Ru",
                "Br"
            ],
            "chemical_system": "Br-Ru",
            "density": 4.308730257941109,
            "density_atomic": 0.030456749616070648,
            "volume": 525.3351129615461,
            "volume_molar": 19.772762477655817,
            "formula_full": "Ru4 Br12",
            "formula_reduced": "RuBr3",
            "formula_anonymous": "AB3",
            "energy": -68.29478629,
            "energy_per_atom": -4.268424143125,
            "energy_above_hull": null,
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            "formation_energy_per_atom": null,
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            "band_gap": 0.0,
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            "total_magnetization": 0.0634828,
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            "updated_at": "2021-11-28T01:35:50.987000Z",
            "spacegroup": 59
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        {
            "id": "mp-1093916",
            "created_at": "2022-09-04T14:42:39.176006Z",
            "structure_string": "Hf1 Zr1 Co2\n1.0\n-4.449838 5.506383 8.487875\n4.449838 -5.506383 8.487875\n4.449838 5.506383 -8.487875\nHf Zr Co\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Hf\n0.000000 0.500000 0.500000 Zr\n0.000000 0.748669 0.748669 Co\n0.000000 0.251331 0.251331 Co\n",
            "nsites": 4,
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            "elements": [
                "Hf",
                "Zr",
                "Co"
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            "chemical_system": "Co-Hf-Zr",
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            "volume": 831.8970468951122,
            "volume_molar": 125.24502785576716,
            "formula_full": "Hf1 Zr1 Co2",
            "formula_reduced": "HfZrCo2",
            "formula_anonymous": "ABC2",
            "energy": -20.18696816,
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            "updated_at": "2021-11-28T01:35:51.038000Z",
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}