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{
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"formula_full": "K8 Ni8 S12 O48",
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"spacegroup": 198
},
{
"id": "mp-1097600",
"created_at": "2022-09-04T14:47:22.171769Z",
"structure_string": "Ti1 Nb1 Os2\n1.0\n-4.632111 5.344552 7.479754\n4.632111 -5.344552 7.479754\n4.632111 5.344552 -7.479754\nTi Nb Os\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.500000 0.500000 Nb\n0.000000 0.249791 0.249791 Os\n0.000000 0.750209 0.750209 Os\n",
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"formula_full": "Ti1 Nb1 Os2",
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},
{
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"structure_string": "Y2 Cr3 O9\n1.0\n3.775145 0.000000 0.000000\n0.000000 3.775145 0.000000\n0.000000 0.000000 11.534588\nY Cr O\n2 3 9\ndirect\n0.500000 0.500000 0.811191 Y\n0.500000 0.500000 0.188809 Y\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.347515 Cr\n0.000000 0.000000 0.652485 Cr\n0.000000 0.000000 0.832994 O\n0.000000 0.000000 0.167006 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.500000 0.313895 O\n0.000000 0.500000 0.686105 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.313895 O\n0.500000 0.000000 0.686105 O\n",
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{
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"created_at": "2022-09-04T14:47:22.175144Z",
"structure_string": "Mg6 B6 Ir6\n1.0\n2.653932 -4.596744 0.000000\n2.653932 4.596744 0.000000\n0.000000 0.000000 9.488446\nMg B Ir\n6 6 6\ndirect\n0.000000 0.500000 0.666667 Mg\n0.000000 0.000000 0.833333 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.166667 Mg\n0.500000 0.500000 0.333333 Mg\n0.500000 0.000000 0.000000 Mg\n0.204885 0.602443 0.166667 B\n0.602443 0.204885 0.500000 B\n0.602443 0.397557 0.833333 B\n0.795115 0.397557 0.166667 B\n0.397557 0.602443 0.833333 B\n0.397557 0.795115 0.500000 B\n0.500000 0.500000 0.044835 Ir\n0.500000 0.000000 0.711502 Ir\n0.500000 0.500000 0.621831 Ir\n0.500000 0.000000 0.288498 Ir\n0.000000 0.500000 0.378169 Ir\n0.000000 0.500000 0.955165 Ir\n",
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{
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"structure_string": "Li4 Fe4 P4 O16\n1.0\n6.063758 0.000000 0.000000\n-1.078206 6.206685 0.000000\n-0.900287 -3.309443 9.374106\nLi Fe P O\n4 4 4 16\ndirect\n0.000215 0.231062 0.740211 Li\n0.825310 0.327836 0.012975 Li\n0.174690 0.672164 0.987025 Li\n0.999785 0.768938 0.259789 Li\n0.626876 0.231292 0.322222 Fe\n0.501045 0.238697 0.742222 Fe\n0.498955 0.761303 0.257778 Fe\n0.373124 0.768708 0.677778 Fe\n0.191502 0.322625 0.435939 P\n0.304674 0.185546 0.045537 P\n0.695326 0.814454 0.954463 P\n0.808498 0.677375 0.564061 P\n0.556457 0.245874 0.114378 O\n0.356597 0.185025 0.406786 O\n0.947633 0.259193 0.371321 O\n0.759623 0.073677 0.878617 O\n0.146984 0.332082 0.067637 O\n0.211197 0.268069 0.601110 O\n0.295658 0.218604 0.883808 O\n0.745192 0.418919 0.630146 O\n0.254808 0.581081 0.369854 O\n0.704342 0.781396 0.116192 O\n0.788803 0.731931 0.398890 O\n0.853016 0.667918 0.932363 O\n0.240377 0.926323 0.121383 O\n0.052367 0.740807 0.628679 O\n0.643403 0.814975 0.593214 O\n0.443543 0.754126 0.885622 O\n",
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"formula_full": "Li4 Fe4 P4 O16",
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{
"id": "mp-1173582",
"created_at": "2022-09-04T14:47:22.179436Z",
"structure_string": "Na6 Zn6 Fe6 P12 O48\n1.0\n10.679358 -0.665010 7.318476\n4.442273 8.015489 1.543963\n-1.359314 -0.223390 9.202143\nNa Zn Fe P O\n6 6 6 12 48\ndirect\n0.001408 0.500663 0.496384 Na\n0.116845 0.994010 0.011301 Na\n0.250000 0.500000 0.500000 Na\n0.383155 0.005990 0.988699 Na\n0.498592 0.499337 0.503616 Na\n0.750000 0.500000 0.500000 Na\n0.098018 0.066985 0.372660 Zn\n0.126910 0.265239 0.725450 Zn\n0.373090 0.734761 0.274550 Zn\n0.401982 0.933015 0.627340 Zn\n0.625705 0.265850 0.734140 Zn\n0.874295 0.734150 0.265860 Zn\n0.349321 0.374144 0.060530 Fe\n0.150679 0.625856 0.939470 Fe\n0.596774 0.060027 0.368176 Fe\n0.846964 0.364327 0.062038 Fe\n0.653036 0.635673 0.937962 Fe\n0.903226 0.939973 0.631824 Fe\n0.075737 0.347623 0.124222 P\n0.126220 0.711565 0.288421 P\n0.327455 0.127045 0.342051 P\n0.172545 0.872955 0.657949 P\n0.373780 0.288435 0.711579 P\n0.572615 0.350572 0.132705 P\n0.424263 0.652377 0.875778 P\n0.627615 0.707672 0.288267 P\n0.822373 0.127726 0.352470 P\n0.677627 0.872274 0.647530 P\n0.872385 0.292328 0.711733 P\n0.927385 0.649428 0.867295 P\n0.028943 0.330379 0.998718 O\n0.137821 0.175034 0.164058 O\n0.183479 0.405682 0.040054 O\n0.059177 0.741492 0.174997 O\n0.290391 0.994031 0.320520 O\n0.024978 0.738811 0.466239 O\n0.041344 0.515774 0.725101 O\n0.212937 0.269509 0.474061 O\n0.373074 0.185519 0.173886 O\n0.225285 0.529936 0.261151 O\n0.195276 0.819473 0.255472 O\n0.439997 0.048291 0.388940 O\n0.060003 0.951709 0.611060 O\n0.304724 0.180527 0.744528 O\n0.530120 0.332986 0.002865 O\n0.274715 0.470064 0.738849 O\n0.126926 0.814481 0.826114 O\n0.287063 0.730491 0.525939 O\n0.458656 0.484226 0.274899 O\n0.622689 0.186202 0.190595 O\n0.475022 0.261189 0.533761 O\n0.209609 0.005969 0.679480 O\n0.440823 0.258508 0.825003 O\n0.683990 0.400892 0.048194 O\n0.316521 0.594318 0.959946 O\n0.561642 0.736405 0.174902 O\n0.778385 0.001604 0.330950 O\n0.528244 0.730377 0.464411 O\n0.362179 0.824966 0.835942 O\n0.535867 0.523477 0.729781 O\n0.708251 0.274991 0.479744 O\n0.881306 0.179285 0.183625 O\n0.733300 0.528900 0.254992 O\n0.471057 0.669621 0.001282 O\n0.693973 0.819822 0.260881 O\n0.930564 0.041925 0.406695 O\n0.569436 0.958075 0.593305 O\n0.806027 0.180178 0.739119 O\n0.766700 0.471100 0.745008 O\n0.618694 0.820715 0.816375 O\n0.791749 0.725009 0.520256 O\n0.964133 0.476523 0.270219 O\n0.971756 0.269623 0.535589 O\n0.721615 0.998396 0.669050 O\n0.938358 0.263595 0.825098 O\n0.816010 0.599108 0.951806 O\n0.877311 0.813798 0.809405 O\n0.969880 0.667014 0.997135 O\n",
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{
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"structure_string": "Li3 V2 C4 O12\n1.0\n-1.958810 -2.172113 -4.478894\n-1.011704 4.304870 -4.753344\n6.667695 -2.351725 -4.777119\nLi V C O\n3 2 4 12\ndirect\n0.253801 0.530195 0.152294 Li\n0.153693 0.061609 0.325655 Li\n0.539825 0.932850 0.690036 Li\n0.881980 0.995586 0.997717 V\n0.637091 0.505453 0.509066 V\n0.736537 0.399647 0.207916 C\n0.728751 0.885057 0.305410 C\n0.916846 0.117333 0.699233 C\n0.338519 0.605694 0.792911 C\n0.749256 0.338680 0.069047 O\n0.980248 0.888851 0.245686 O\n0.561414 0.949221 0.211814 O\n0.951848 0.395769 0.255023 O\n0.490690 0.471691 0.321600 O\n0.647205 0.817385 0.454795 O\n0.909772 0.195570 0.550225 O\n0.594445 0.606520 0.748271 O\n0.262391 0.559735 0.672381 O\n0.701519 0.079672 0.794105 O\n0.131673 0.073976 0.752944 O\n0.175915 0.649962 0.939361 O\n",
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{
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"structure_string": "Rb10 Re6 S14\n1.0\n10.742272 0.000000 0.000000\n5.285696 9.352801 0.000000\n5.278420 3.123245 8.877279\nRb Re S\n10 6 14\ndirect\n0.011503 0.991679 0.995342 Rb\n0.414470 0.580130 0.003967 Rb\n0.423016 0.999675 0.999977 Rb\n0.570916 0.139626 0.140945 Rb\n0.003151 0.572240 0.008344 Rb\n0.420849 0.000611 0.579245 Rb\n0.026428 0.424369 0.521784 Rb\n0.000918 0.004750 0.570939 Rb\n0.862225 0.858776 0.423905 Rb\n0.844072 0.427757 0.892710 Rb\n0.621730 0.375514 0.378307 Re\n0.622876 0.624065 0.378332 Re\n0.623740 0.377921 0.623349 Re\n0.375225 0.623131 0.377390 Re\n0.375686 0.377000 0.622380 Re\n0.377279 0.624036 0.622544 Re\n0.777673 0.211166 0.223464 S\n0.780238 0.784555 0.222034 S\n0.611919 0.612362 0.162769 S\n0.837570 0.386535 0.386968 S\n0.612906 0.160430 0.613070 S\n0.783410 0.224817 0.784208 S\n0.387218 0.384838 0.385198 S\n0.614767 0.614957 0.613922 S\n0.214354 0.780190 0.221384 S\n0.386786 0.839731 0.388002 S\n0.159871 0.613178 0.611959 S\n0.388602 0.387211 0.837328 S\n0.209952 0.223614 0.779556 S\n0.217150 0.784435 0.781979 S\n",
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