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{
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{
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"formula_full": "Mg2 Ti6 Zn2 Ni2 O18",
"formula_reduced": "MgTi3ZnNiO9",
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{
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"structure_string": "Mg1 Tl4 Ni4 O12\n1.0\n5.679462 -0.365466 -0.646543\n-0.365140 5.568197 0.332062\n-0.820339 0.368938 8.767841\nMg Tl Ni O\n1 4 4 12\ndirect\n0.249245 0.439392 0.874316 Mg\n0.472008 0.500502 0.242847 Tl\n0.003547 0.970127 0.713461 Tl\n0.596592 0.414049 0.660052 Tl\n0.004835 0.033677 0.233490 Tl\n0.437779 0.994947 0.030303 Ni\n0.571009 0.989364 0.451968 Ni\n0.051145 0.526984 0.460025 Ni\n0.890132 0.551585 0.030001 Ni\n0.716947 0.322720 0.443062 O\n0.579844 0.322493 0.978932 O\n0.204361 0.335280 0.652695 O\n0.906579 0.851266 0.461341 O\n0.718658 0.807993 0.104511 O\n0.402848 0.064658 0.245720 O\n0.134596 0.108065 0.952694 O\n0.612965 0.001775 0.671814 O\n0.917006 0.581988 0.804172 O\n0.262551 0.679252 0.032578 O\n0.042134 0.421534 0.247197 O\n0.400219 0.677587 0.458819 O\n",
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{
"id": "mp-1233036",
"created_at": "2022-09-04T14:45:40.021426Z",
"structure_string": "Mg1 Tl4 Ni4 O12\n1.0\n5.375098 0.144677 -0.139107\n0.135729 5.686906 -0.282568\n-0.162500 -0.324465 8.423251\nMg Tl Ni O\n1 4 4 12\ndirect\n0.901273 0.227564 0.598916 Mg\n0.522017 0.552788 0.230542 Tl\n0.001524 0.869476 0.817042 Tl\n0.454772 0.426949 0.770934 Tl\n0.981867 0.077927 0.244805 Tl\n0.500671 0.983870 0.020370 Ni\n0.479641 0.968179 0.513626 Ni\n0.033974 0.607577 0.447206 Ni\n0.997216 0.466307 0.010650 Ni\n0.753028 0.402768 0.423377 O\n0.701853 0.266048 0.069809 O\n0.263500 0.237471 0.560031 O\n0.832451 0.913424 0.453702 O\n0.803776 0.788965 0.070536 O\n0.379117 0.931322 0.271627 O\n0.213065 0.170956 0.938863 O\n0.659697 0.059500 0.732329 O\n0.875626 0.499360 0.778182 O\n0.316851 0.683162 0.959282 O\n0.132050 0.451828 0.236120 O\n0.296030 0.735987 0.593716 O\n",
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{
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"structure_string": "Mg1 Tl4 Ni4 O12\n1.0\n5.455347 -0.192841 -0.282084\n-0.196548 5.534545 0.281888\n-0.410960 0.413719 8.560366\nMg Tl Ni O\n1 4 4 12\ndirect\n0.858313 0.148601 0.897251 Mg\n0.529059 0.540658 0.262646 Tl\n0.017097 0.866329 0.672803 Tl\n0.478665 0.559201 0.820512 Tl\n0.995434 0.036954 0.269285 Tl\n0.446773 0.043457 0.040628 Ni\n0.510890 0.979231 0.495243 Ni\n0.030734 0.448972 0.476106 Ni\n0.993745 0.556653 0.026342 Ni\n0.743506 0.249732 0.408949 O\n0.674166 0.330508 0.060208 O\n0.208521 0.161795 0.530892 O\n0.824814 0.726548 0.432723 O\n0.774213 0.858108 0.066573 O\n0.384385 0.929897 0.265091 O\n0.205939 0.264922 0.954135 O\n0.662936 0.984335 0.724095 O\n0.859963 0.502324 0.794077 O\n0.247192 0.791413 0.937816 O\n0.131367 0.448398 0.248365 O\n0.297286 0.655298 0.574591 O\n",
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{
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"structure_string": "Mg1 V4 Ni2 O12\n1.0\n7.186171 -0.441411 0.097731\n-1.176316 7.083048 -0.080460\n-1.485410 1.349800 5.203646\nMg V Ni O\n1 4 2 12\ndirect\n0.590382 0.589350 0.238199 Mg\n0.183213 0.634761 0.716757 V\n0.375012 0.873503 0.171974 V\n0.634984 0.185791 0.785429 V\n0.875544 0.374674 0.331425 V\n0.081747 0.081683 0.750231 Ni\n0.922267 0.921744 0.250290 Ni\n0.033501 0.807666 0.643980 O\n0.054908 0.399691 0.686449 O\n0.175201 0.993168 0.129023 O\n0.338159 0.702236 0.511131 O\n0.401037 0.055264 0.814586 O\n0.323002 0.632098 0.040545 O\n0.699268 0.339555 0.993138 O\n0.631083 0.870074 0.275873 O\n0.634208 0.326322 0.461495 O\n0.807767 0.035836 0.857604 O\n0.875022 0.631921 0.221449 O\n0.993695 0.174664 0.370424 O\n",
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{
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"structure_string": "Mg6 V1 Ni1 O8\n1.0\n8.518737 0.000000 0.000000\n0.000000 4.275356 0.000000\n0.000000 0.000000 4.275356\nMg V Ni O\n6 1 1 8\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.249966 0.000000 0.500000 Mg\n0.750034 0.000000 0.500000 Mg\n0.249966 0.500000 0.000000 Mg\n0.750034 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ni\n0.249834 0.000000 0.000000 O\n0.750166 0.000000 0.000000 O\n0.255487 0.500000 0.500000 O\n0.744513 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
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{
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{
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"structure_string": "Mg1 V4 Ni2 O12\n1.0\n6.863403 -0.372748 -0.040529\n-1.073653 6.792446 0.039076\n-1.517113 1.369120 5.296191\nMg V Ni O\n1 4 2 12\ndirect\n0.292606 0.292769 0.248934 Mg\n0.178217 0.625796 0.710739 V\n0.393231 0.838540 0.182033 V\n0.624943 0.177978 0.789457 V\n0.837665 0.392834 0.318470 V\n0.084923 0.085047 0.749631 Ni\n0.934366 0.935173 0.249950 Ni\n0.027348 0.815039 0.635893 O\n0.019637 0.390758 0.694412 O\n0.211567 0.024861 0.141685 O\n0.333694 0.666583 0.506179 O\n0.390426 0.018402 0.805682 O\n0.311267 0.589109 0.041058 O\n0.665214 0.333216 0.994271 O\n0.643995 0.907427 0.290628 O\n0.588231 0.311866 0.459613 O\n0.814813 0.027990 0.863568 O\n0.902779 0.644155 0.210307 O\n0.025078 0.212459 0.357491 O\n",
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