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{
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{
"id": "mp-1195488",
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"structure_string": "Sr2 Fe2 Ni4 P6 O24\n1.0\n-3.290288 5.247829 6.648609\n3.290288 -5.247829 6.648609\n3.290288 5.247829 -6.648609\nSr Fe Ni P O\n2 2 4 6 24\ndirect\n0.250000 0.343318 0.093318 Sr\n0.750000 0.656682 0.906682 Sr\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.116450 0.116450 0.500000 Ni\n0.383550 0.883550 0.000000 Ni\n0.616450 0.116450 0.000000 Ni\n0.883550 0.883550 0.500000 Ni\n0.250000 0.837941 0.587941 P\n0.750000 0.162059 0.412059 P\n0.321807 0.321807 0.500000 P\n0.178193 0.678193 0.000000 P\n0.821807 0.321807 0.000000 P\n0.678193 0.678193 0.500000 P\n0.344040 0.795143 0.451104 O\n0.655960 0.204857 0.548896 O\n0.844040 0.392936 0.548896 O\n0.155960 0.607064 0.451104 O\n0.132133 0.983304 0.615436 O\n0.632133 0.016696 0.148829 O\n0.867867 0.016696 0.384564 O\n0.367867 0.983304 0.851171 O\n0.347299 0.202490 0.277667 O\n0.075177 0.797510 0.144809 O\n0.847299 0.569632 0.144809 O\n0.575177 0.430368 0.277667 O\n0.652701 0.797510 0.722333 O\n0.924823 0.202490 0.855191 O\n0.152701 0.430368 0.855191 O\n0.424823 0.569632 0.722333 O\n0.132354 0.287032 0.431056 O\n0.144025 0.712968 0.845323 O\n0.632354 0.201298 0.845323 O\n0.644025 0.798702 0.431056 O\n0.867646 0.712968 0.568944 O\n0.855975 0.287032 0.154677 O\n0.367646 0.798702 0.154677 O\n0.355975 0.201298 0.568944 O\n",
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},
{
"id": "mp-753647",
"created_at": "2022-09-04T14:46:13.126845Z",
"structure_string": "Li4 Fe4 Si2 O12\n1.0\n5.353030 -0.000020 0.000001\n-2.676533 4.832960 6.065667\n2.676535 -4.832962 6.065670\nLi Fe Si O\n4 4 2 12\ndirect\n0.999999 0.141725 0.141727 Li\n0.000001 0.641727 0.641725 Li\n0.000001 0.358287 0.358285 Li\n0.999999 0.858285 0.858287 Li\n0.000000 0.084922 0.584922 Fe\n0.499999 0.415073 0.915073 Fe\n0.000000 0.584912 0.084912 Fe\n0.500000 0.915083 0.415083 Fe\n0.499995 0.999993 0.000004 Si\n0.500005 0.500004 0.499993 Si\n0.165818 0.415820 0.084175 O\n0.165818 0.915827 0.584181 O\n0.834182 0.584175 0.915820 O\n0.834182 0.084181 0.415827 O\n0.219741 0.831081 0.013598 O\n0.219740 0.331088 0.513597 O\n0.597711 0.486394 0.668914 O\n0.597702 0.986393 0.168920 O\n0.402290 0.168914 0.986394 O\n0.402298 0.668920 0.486394 O\n0.780259 0.513597 0.331081 O\n0.780260 0.013597 0.831088 O\n",
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"formula_full": "Li4 Fe4 Si2 O12",
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"spacegroup": 21
},
{
"id": "mp-1396333",
"created_at": "2022-09-04T14:45:57.516531Z",
"structure_string": "Mg4 Ti4 O8\n1.0\n1.441602 7.920209 0.000000\n-1.441602 7.920209 0.000000\n0.000000 6.486955 7.846326\nMg Ti O\n4 4 8\ndirect\n0.678623 0.678623 0.280235 Mg\n0.321377 0.321377 0.719765 Mg\n0.975782 0.975782 0.387103 Mg\n0.024218 0.024218 0.612897 Mg\n0.389203 0.389203 0.944859 Ti\n0.817135 0.817135 0.357724 Ti\n0.182865 0.182865 0.642276 Ti\n0.610797 0.610797 0.055141 Ti\n0.154851 0.154851 0.885508 O\n0.547033 0.547033 0.740954 O\n0.452967 0.452967 0.259046 O\n0.845149 0.845149 0.114492 O\n0.852443 0.852443 0.834535 O\n0.193330 0.193330 0.416662 O\n0.147557 0.147557 0.165465 O\n0.806670 0.806670 0.583338 O\n",
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"volume": 179.17539150207995,
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"formula_full": "Mg4 Ti4 O8",
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"spacegroup": 12
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{
"id": "mp-1097649",
"created_at": "2022-09-04T14:46:10.741728Z",
"structure_string": "Y1 Zn1 Hg2\n1.0\n-5.841188 6.227087 8.804754\n5.841188 -6.227087 8.804754\n5.841188 6.227087 -8.804754\nY Zn Hg\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Zn\n0.000000 0.236080 0.236080 Hg\n0.000000 0.763920 0.763920 Hg\n",
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],
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"formula_full": "Y1 Zn1 Hg2",
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},
{
"id": "mp-756484",
"created_at": "2022-09-04T14:46:07.516726Z",
"structure_string": "Li4 Ti2 Fe2 O8\n1.0\n-2.896615 1.683939 -2.357453\n-2.839277 -1.619100 2.331673\n-2.811667 7.301314 5.101211\nLi Ti Fe O\n4 2 2 8\ndirect\n0.873403 0.373021 0.253695 Li\n0.629366 0.129432 0.741762 Li\n0.485926 0.485234 0.028850 Li\n0.262086 0.263164 0.474248 Li\n0.748243 0.752166 0.499253 Ti\n0.003455 0.001583 0.996126 Ti\n0.376178 0.875768 0.248126 Fe\n0.118845 0.618871 0.762641 Fe\n0.874118 0.873793 0.252111 O\n0.642554 0.642277 0.715368 O\n0.753293 0.252785 0.492835 O\n0.250341 0.749619 0.500794 O\n0.375364 0.374979 0.249731 O\n0.111844 0.112038 0.776164 O\n0.497777 0.998230 0.002914 O\n0.997207 0.497040 0.005382 O\n",
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"elements": [
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],
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"formula_full": "Li4 Ti2 Fe2 O8",
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{
"id": "mp-1198422",
"created_at": "2022-09-04T14:46:07.528508Z",
"structure_string": "Dy4 Mo16 O66\n1.0\n10.514231 0.000000 0.000000\n0.000000 9.373380 0.000000\n0.000000 0.321063 14.218186\nDy Mo O\n4 16 66\ndirect\n0.484433 0.277214 0.063298 Dy\n0.984433 0.722786 0.936702 Dy\n0.786296 0.229364 0.426925 Dy\n0.286296 0.770636 0.573075 Dy\n0.419940 0.882459 0.155725 Mo\n0.919940 0.117541 0.844275 Mo\n0.208963 0.607341 0.318640 Mo\n0.708963 0.392659 0.681360 Mo\n0.997415 0.375757 0.217443 Mo\n0.497415 0.624243 0.782557 Mo\n0.076505 0.904703 0.182404 Mo\n0.576505 0.095297 0.817596 Mo\n0.043760 0.900064 0.418392 Mo\n0.543760 0.099936 0.581608 Mo\n0.284500 0.140485 0.281317 Mo\n0.784500 0.859515 0.718683 Mo\n0.867172 0.628910 0.348073 Mo\n0.367172 0.371090 0.651927 Mo\n0.245792 0.612967 0.083128 Mo\n0.745792 0.387033 0.916872 Mo\n0.064850 0.498600 0.351391 O\n0.564850 0.501400 0.648609 O\n0.484355 0.032249 0.087381 O\n0.984355 0.967751 0.912619 O\n0.968823 0.341921 0.102015 O\n0.468823 0.658079 0.897985 O\n0.339322 0.779711 0.051403 O\n0.839322 0.220289 0.948597 O\n0.221927 0.012781 0.147545 O\n0.721927 0.987219 0.852455 O\n0.386209 0.252123 0.204581 O\n0.886209 0.747877 0.795419 O\n0.741949 0.741445 0.328303 O\n0.241949 0.258555 0.671697 O\n0.018987 0.778095 0.288612 O\n0.518987 0.221905 0.711388 O\n0.949742 0.013452 0.161651 O\n0.449742 0.986548 0.838349 O\n0.133273 0.933635 0.520820 O\n0.633273 0.066365 0.479180 O\n0.147841 0.522411 0.184618 O\n0.647841 0.477589 0.815382 O\n0.887495 0.544159 0.227879 O\n0.387495 0.455841 0.772121 O\n0.267871 0.737669 0.213507 O\n0.767871 0.262331 0.786493 O\n0.155343 0.577874 0.981326 O\n0.655343 0.422126 0.018674 O\n0.137143 0.253229 0.248823 O\n0.637143 0.746771 0.751177 O\n0.142195 0.989546 0.316404 O\n0.642195 0.010454 0.683596 O\n0.066057 0.777242 0.086763 O\n0.566057 0.222758 0.913237 O\n0.368165 0.483524 0.076526 O\n0.868165 0.516476 0.923474 O\n0.218109 0.732371 0.416468 O\n0.718109 0.267629 0.583532 O\n0.314366 0.186424 0.394261 O\n0.814366 0.813576 0.605739 O\n0.545460 0.772399 0.179852 O\n0.045460 0.227601 0.820148 O\n0.400303 0.976751 0.272883 O\n0.900303 0.023249 0.727117 O\n0.335672 0.498330 0.339624 O\n0.835672 0.501670 0.660376 O\n0.886616 0.263542 0.287221 O\n0.386616 0.736458 0.712779 O\n0.920824 0.031283 0.424280 O\n0.420824 0.968717 0.575720 O\n0.952207 0.732462 0.451000 O\n0.452207 0.267538 0.549000 O\n0.800224 0.476187 0.410660 O\n0.300224 0.523813 0.589340 O\n0.277728 0.178293 0.019002 O\n0.777728 0.821707 0.980998 O\n0.602966 0.342807 0.354273 O\n0.102966 0.657193 0.645727 O\n0.666211 0.172921 0.137326 O\n0.166211 0.827079 0.862674 O\n0.500039 0.712128 0.531125 O\n0.000039 0.287872 0.468875 O\n0.687888 0.159041 0.280637 O\n0.187888 0.840959 0.719363 O\n0.578862 0.353693 0.209793 O\n0.078862 0.646307 0.790207 O\n",
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{
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"structure_string": "Co8 O8 F8\n1.0\n2.891373 0.000000 0.000000\n0.000000 4.739578 0.000000\n0.000000 1.771651 18.617789\nCo O F\n8 8 8\ndirect\n0.000000 0.088909 0.876950 Co\n0.000000 0.911091 0.123050 Co\n0.000000 0.978446 0.373792 Co\n0.000000 0.021554 0.626208 Co\n0.500000 0.500000 0.000000 Co\n0.500000 0.452744 0.245413 Co\n0.500000 0.500000 0.500000 Co\n0.500000 0.547256 0.754587 Co\n0.500000 0.759270 0.077986 O\n0.000000 0.681624 0.451896 O\n0.000000 0.727931 0.704819 O\n0.000000 0.630123 0.197662 O\n0.000000 0.272069 0.295181 O\n0.000000 0.369877 0.802338 O\n0.000000 0.318376 0.548104 O\n0.500000 0.240730 0.922014 O\n0.500000 0.778547 0.325614 F\n0.500000 0.823891 0.577438 F\n0.500000 0.900336 0.829536 F\n0.000000 0.748346 0.948334 F\n0.000000 0.251654 0.051666 F\n0.500000 0.099664 0.170464 F\n0.500000 0.176109 0.422562 F\n0.500000 0.221453 0.674386 F\n",
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{
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"structure_string": "Na1 Mg6 Co1 O8\n1.0\n8.430118 0.000000 0.000000\n0.000000 4.319945 0.000000\n0.000000 0.000000 4.319945\nNa Mg Co O\n1 6 1 8\ndirect\n0.500000 0.000000 0.000000 Na\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.255177 0.000000 0.500000 Mg\n0.744823 0.000000 0.500000 Mg\n0.255177 0.500000 0.000000 Mg\n0.744823 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Co\n0.221753 0.000000 0.000000 O\n0.778247 0.000000 0.000000 O\n0.246796 0.500000 0.500000 O\n0.753204 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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