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{
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{
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{
"id": "mp-769514",
"created_at": "2022-09-04T14:47:09.676791Z",
"structure_string": "Li9 Mn12 Cu3 O32\n1.0\n5.850679 -5.873671 0.000000\n5.850679 5.873671 0.000000\n-0.046076 0.000000 8.290255\nLi Mn Cu O\n9 12 3 32\ndirect\n0.995963 0.995963 0.995963 Li\n0.622895 0.877287 0.121818 Li\n0.753783 0.753783 0.753783 Li\n0.249061 0.747572 0.246328 Li\n0.121818 0.622895 0.877287 Li\n0.375167 0.375167 0.375167 Li\n0.246328 0.249061 0.747572 Li\n0.747572 0.246328 0.249061 Li\n0.877287 0.121818 0.622895 Li\n0.370851 0.878693 0.874152 Mn\n0.122171 0.876579 0.623006 Mn\n0.878693 0.874152 0.370851 Mn\n0.375393 0.623892 0.621795 Mn\n0.623892 0.621795 0.375393 Mn\n0.876579 0.623006 0.122171 Mn\n0.621795 0.375393 0.623892 Mn\n0.874152 0.370851 0.878693 Mn\n0.117967 0.375212 0.122753 Mn\n0.623006 0.122171 0.876579 Mn\n0.375212 0.122753 0.117967 Mn\n0.122753 0.117967 0.375212 Mn\n0.487313 0.508757 0.006543 Cu\n0.006543 0.487313 0.508757 Cu\n0.508757 0.006543 0.487313 Cu\n0.601960 0.898746 0.871692 O\n0.368779 0.894385 0.101720 O\n0.111100 0.886706 0.384177 O\n0.898746 0.871692 0.601960 O\n0.140796 0.876543 0.849328 O\n0.361626 0.863048 0.633665 O\n0.646145 0.857948 0.383255 O\n0.876543 0.849328 0.140796 O\n0.383255 0.646145 0.857948 O\n0.146361 0.637447 0.618032 O\n0.863048 0.633665 0.361626 O\n0.637447 0.618032 0.146361 O\n0.397043 0.628255 0.393121 O\n0.613442 0.613442 0.613442 O\n0.871692 0.601960 0.898746 O\n0.102254 0.601548 0.128209 O\n0.393121 0.397043 0.628255 O\n0.628255 0.393121 0.397043 O\n0.886706 0.384177 0.111100 O\n0.101720 0.368779 0.894385 O\n0.857948 0.383255 0.646145 O\n0.633665 0.361626 0.863048 O\n0.349736 0.361429 0.123348 O\n0.123348 0.349736 0.361429 O\n0.618032 0.146361 0.637447 O\n0.849328 0.140796 0.876543 O\n0.137082 0.137082 0.137082 O\n0.361429 0.123348 0.349736 O\n0.601548 0.128209 0.102254 O\n0.384177 0.111100 0.886706 O\n0.128209 0.102254 0.601548 O\n0.894385 0.101720 0.368779 O\n",
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"formula_full": "Li9 Mn12 Cu3 O32",
"formula_reduced": "Li9Mn12Cu3O32",
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"spacegroup": 146
},
{
"id": "mp-771690",
"created_at": "2022-09-04T14:47:09.397399Z",
"structure_string": "Li3 Mg1 Ni3 O8\n1.0\n5.786929 0.000000 0.000000\n0.000000 4.918799 0.000000\n0.000000 1.590033 4.841213\nLi Mg Ni O\n3 1 3 8\ndirect\n0.500000 0.000000 0.500000 Li\n0.759210 0.500000 0.500000 Li\n0.240790 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Mg\n0.752687 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.247313 0.000000 0.000000 Ni\n0.500000 0.217607 0.773980 O\n0.500000 0.782393 0.226020 O\n0.762558 0.255752 0.209445 O\n0.762558 0.744248 0.790555 O\n0.000000 0.750419 0.208328 O\n0.000000 0.249581 0.791672 O\n0.237442 0.255752 0.209445 O\n0.237442 0.744248 0.790555 O\n",
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],
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"formula_full": "Li3 Mg1 Ni3 O8",
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{
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"created_at": "2022-09-04T14:47:09.462068Z",
"structure_string": "Mg2 Ti4 O8\n1.0\n5.358044 -2.966540 0.000000\n5.358044 2.966540 0.000000\n3.715587 0.000000 4.868615\nMg Ti O\n2 4 8\ndirect\n0.996952 0.996952 0.996952 Mg\n0.630550 0.630550 0.630550 Mg\n0.245554 0.245554 0.245554 Ti\n0.617062 0.136415 0.617062 Ti\n0.617062 0.617062 0.136415 Ti\n0.136415 0.617062 0.617062 Ti\n0.858429 0.383218 0.383218 O\n0.383218 0.383218 0.858429 O\n0.383218 0.858429 0.383218 O\n0.367891 0.367891 0.367891 O\n0.864625 0.864625 0.864625 O\n0.873281 0.402456 0.873281 O\n0.873281 0.873281 0.402456 O\n0.402456 0.873281 0.873281 O\n",
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{
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{
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"structure_string": "K2 Ce2 Ag2 Te8\n1.0\n4.468011 0.000000 0.000000\n0.000000 4.472137 0.000000\n0.000000 0.000000 21.376489\nK Ce Ag Te\n2 2 2 8\ndirect\n0.523188 0.500000 0.649115 K\n0.023188 0.000000 0.350885 K\n0.505991 0.500000 0.097565 Ce\n0.005991 0.000000 0.902435 Ce\n0.525485 0.000000 0.499755 Ag\n0.025485 0.500000 0.500245 Ag\n0.505194 0.500000 0.945147 Te\n0.524797 0.500000 0.416286 Te\n0.507602 0.000000 0.791992 Te\n0.005194 0.000000 0.054853 Te\n0.508387 0.000000 0.208463 Te\n0.024797 0.000000 0.583714 Te\n0.007602 0.500000 0.208008 Te\n0.008387 0.500000 0.791537 Te\n",
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{
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"structure_string": "Ta8 Cr4 O24\n1.0\n4.826353 -0.021960 0.042715\n0.102262 -4.872604 9.378965\n0.043914 -9.656656 0.047263\nTa Cr O\n8 4 24\ndirect\n0.505862 0.166165 0.170482 Ta\n0.499501 0.170982 0.667065 Ta\n0.997692 0.668100 0.161943 Ta\n0.003367 0.667411 0.666043 Ta\n0.494147 0.833813 0.829572 Ta\n0.500532 0.828975 0.332868 Ta\n0.996523 0.332661 0.333894 Ta\n0.002470 0.331973 0.838095 Ta\n0.499906 0.499937 0.000107 Cr\n0.000157 0.000020 0.500054 Cr\n0.499822 0.499807 0.500183 Cr\n0.999388 0.000192 0.999793 Cr\n0.311969 0.997860 0.342898 O\n0.313747 0.001766 0.844282 O\n0.194565 0.502250 0.846160 O\n0.174640 0.499050 0.337350 O\n0.805547 0.497729 0.153810 O\n0.825508 0.500939 0.662648 O\n0.686025 0.998228 0.155640 O\n0.688288 0.002114 0.657197 O\n0.290829 0.309236 0.205244 O\n0.306833 0.327582 0.692443 O\n0.203637 0.825808 0.684488 O\n0.192981 0.820411 0.186856 O\n0.776387 0.810495 0.987120 O\n0.789683 0.811489 0.481002 O\n0.796585 0.174145 0.315513 O\n0.806810 0.179754 0.812992 O\n0.223655 0.189472 0.012933 O\n0.210447 0.188553 0.518894 O\n0.713388 0.321861 0.992610 O\n0.705162 0.322123 0.490720 O\n0.286728 0.678068 0.007472 O\n0.294811 0.677936 0.509220 O\n0.709280 0.690764 0.794780 O\n0.693129 0.672329 0.307628 O\n",
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{
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"structure_string": "Sm2 Ga2 Fe15\n1.0\n4.258282 4.851166 0.000000\n-4.258282 4.851166 0.000000\n0.000000 1.038927 6.425033\nSm Ga Fe\n2 2 15\ndirect\n0.337914 0.337914 0.333637 Sm\n0.656731 0.656731 0.657769 Sm\n0.655888 0.152796 0.655825 Ga\n0.152796 0.655888 0.655825 Ga\n0.095847 0.095847 0.097282 Fe\n0.904402 0.904402 0.908413 Fe\n0.998943 0.711530 0.288574 Fe\n0.710150 0.290975 0.001251 Fe\n0.288626 0.003331 0.712036 Fe\n0.290975 0.710150 0.001251 Fe\n0.711530 0.998943 0.288574 Fe\n0.003331 0.288626 0.712036 Fe\n0.500734 0.000474 0.002306 Fe\n0.003938 0.003938 0.496655 Fe\n0.000474 0.500734 0.002306 Fe\n0.657654 0.657654 0.154454 Fe\n0.343652 0.846459 0.337468 Fe\n0.846459 0.343652 0.337468 Fe\n0.339954 0.339954 0.856867 Fe\n",
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{
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{
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}