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{
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{
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{
"id": "mp-1220033",
"created_at": "2022-09-04T14:42:07.628782Z",
"structure_string": "Pr4 U2 Te10\n1.0\n3.136690 9.353557 0.000000\n-3.136690 9.353557 0.000000\n0.000000 0.140028 8.902718\nPr U Te\n4 2 10\ndirect\n0.250265 0.249772 0.266296 Pr\n0.579931 0.591232 0.261910 Pr\n0.750228 0.749735 0.733704 Pr\n0.408768 0.420069 0.738090 Pr\n0.931018 0.907214 0.261430 U\n0.092786 0.068982 0.738570 U\n0.246353 0.246692 0.639152 Te\n0.914568 0.922154 0.628303 Te\n0.590412 0.577900 0.636908 Te\n0.753308 0.753647 0.360848 Te\n0.422100 0.409588 0.363092 Te\n0.077846 0.085432 0.371697 Te\n0.420931 0.934977 0.998613 Te\n0.065023 0.579069 0.001387 Te\n0.750193 0.249807 0.000000 Te\n0.246279 0.753721 0.000000 Te\n",
"nsites": 16,
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"density": 7.360854142946151,
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"formula_full": "Pr4 U2 Te10",
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{
"id": "mp-1212282",
"created_at": "2022-09-04T14:42:07.628689Z",
"structure_string": "K4 Ni2 C4 O20\n1.0\n6.241641 0.000000 0.000000\n0.000000 6.961375 0.000000\n0.000000 4.142175 10.607884\nK Ni C O\n4 2 4 20\ndirect\n0.340620 0.722030 0.339843 K\n0.659380 0.277970 0.660157 K\n0.840620 0.277970 0.160157 K\n0.159380 0.722030 0.839843 K\n0.000000 0.000000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.827675 0.772464 0.165503 C\n0.172325 0.227536 0.834497 C\n0.327675 0.227536 0.334497 C\n0.672325 0.772464 0.665503 C\n0.947206 0.662391 0.248942 O\n0.052794 0.337609 0.751058 O\n0.447206 0.337609 0.251058 O\n0.552794 0.662391 0.748942 O\n0.761392 0.878232 0.443581 O\n0.238608 0.121768 0.556419 O\n0.261392 0.121768 0.056419 O\n0.738608 0.878232 0.943581 O\n0.332085 0.785151 0.065672 O\n0.667915 0.214849 0.934328 O\n0.832085 0.214849 0.434328 O\n0.167915 0.785151 0.565672 O\n0.861015 0.745411 0.046951 O\n0.138985 0.254589 0.953049 O\n0.361015 0.254589 0.453049 O\n0.638985 0.745411 0.546951 O\n0.683610 0.901402 0.165656 O\n0.316390 0.098598 0.834344 O\n0.183610 0.098598 0.334344 O\n0.816390 0.901402 0.665656 O\n",
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{
"id": "mp-1113905",
"created_at": "2022-09-04T14:42:07.661555Z",
"structure_string": "Rb2 Y1 Hg1 F6\n1.0\n0.000000 4.775782 4.775782\n4.775782 0.000000 4.775782\n4.775782 4.775782 0.000000\nRb Y Hg F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Hg\n0.771453 0.228547 0.228547 F\n0.228547 0.228547 0.771453 F\n0.228547 0.771453 0.771453 F\n0.228547 0.771453 0.228547 F\n0.771453 0.228547 0.771453 F\n0.771453 0.771453 0.228547 F\n",
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{
"id": "mp-775821",
"created_at": "2022-09-04T14:42:07.628022Z",
"structure_string": "Ti16 N16 O8\n1.0\n8.206594 0.000000 0.000000\n-2.723027 7.747089 0.000000\n-2.737859 -3.873451 6.728065\nTi N O\n16 16 8\ndirect\n0.997087 0.011322 0.499179 Ti\n0.302165 0.748230 0.540043 Ti\n0.948741 0.699123 0.738732 Ti\n0.466867 0.215025 0.753945 Ti\n0.208000 0.261394 0.960341 Ti\n0.743455 0.959925 0.706189 Ti\n0.749910 0.450987 0.208301 Ti\n0.506587 0.994082 0.005083 Ti\n0.249380 0.535963 0.791309 Ti\n0.260669 0.048929 0.302249 Ti\n0.996289 0.488500 0.987175 Ti\n0.507752 0.511419 0.512062 Ti\n0.790436 0.748140 0.039155 Ti\n0.539442 0.798153 0.249918 Ti\n0.039741 0.286198 0.252463 Ti\n0.706609 0.250708 0.457567 Ti\n0.994244 0.041000 0.269107 N\n0.232623 0.270173 0.724577 N\n0.725215 0.461349 0.954758 N\n0.960271 0.452710 0.728154 N\n0.263241 0.491046 0.537753 N\n0.544955 0.009008 0.773171 N\n0.738201 0.513783 0.459008 N\n0.726074 0.732503 0.774130 N\n0.953025 0.226974 0.960999 N\n0.275810 0.537587 0.051585 N\n0.542231 0.767905 0.991963 N\n0.772062 0.223988 0.228609 N\n0.444848 0.987995 0.222369 N\n0.505517 0.272928 0.547714 N\n0.486255 0.724570 0.447701 N\n0.777334 0.049379 0.509166 N\n0.039270 0.552917 0.278118 O\n0.008431 0.955123 0.731309 O\n0.222858 0.944355 0.485439 O\n0.274111 0.259966 0.220836 O\n0.049080 0.775426 0.040922 O\n0.459700 0.238821 0.014623 O\n0.222938 0.776236 0.768195 O\n0.768576 0.726158 0.276081 O\n",
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"elements": [
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"formula_full": "Ti16 N16 O8",
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{
"id": "mp-556091",
"created_at": "2022-09-04T14:42:07.637536Z",
"structure_string": "Cs12 Ta8 S44\n1.0\n8.344145 0.000000 0.000000\n0.000000 12.326837 0.000000\n0.000000 4.263813 19.624353\nCs Ta S\n12 8 44\ndirect\n0.840639 0.963733 0.641895 Cs\n0.818290 0.503390 0.662691 Cs\n0.681710 0.503390 0.162691 Cs\n0.687296 0.729030 0.381719 Cs\n0.181710 0.496610 0.337309 Cs\n0.659361 0.963733 0.141895 Cs\n0.318290 0.496610 0.837309 Cs\n0.187296 0.270970 0.118281 Cs\n0.812704 0.729030 0.881719 Cs\n0.159361 0.036267 0.358105 Cs\n0.312704 0.270970 0.618281 Cs\n0.340639 0.036267 0.858105 Cs\n0.143380 0.789787 0.156737 Ta\n0.778222 0.306832 0.493419 Ta\n0.278222 0.693168 0.006581 Ta\n0.221778 0.693168 0.506581 Ta\n0.356620 0.789787 0.656737 Ta\n0.643380 0.210213 0.343263 Ta\n0.721778 0.306832 0.993419 Ta\n0.856620 0.210213 0.843263 Ta\n0.470468 0.584534 0.544137 S\n0.948993 0.747115 0.530926 S\n0.726053 0.388339 0.845577 S\n0.122232 0.500017 0.512717 S\n0.422874 0.978141 0.592784 S\n0.745318 0.249911 0.606063 S\n0.029532 0.584534 0.044137 S\n0.113500 0.708807 0.714888 S\n0.985636 0.247573 0.951889 S\n0.377768 0.500017 0.012717 S\n0.485636 0.752427 0.548111 S\n0.936517 0.736297 0.227145 S\n0.063483 0.263703 0.772855 S\n0.014364 0.752427 0.048111 S\n0.386500 0.708807 0.214888 S\n0.622232 0.499983 0.987283 S\n0.922874 0.021859 0.907216 S\n0.551007 0.747115 0.030926 S\n0.436517 0.263703 0.272855 S\n0.718418 0.027933 0.320574 S\n0.514364 0.247573 0.451889 S\n0.218418 0.972067 0.179426 S\n0.886500 0.291193 0.285112 S\n0.613500 0.291193 0.785112 S\n0.226053 0.611661 0.654423 S\n0.128675 0.862224 0.540804 S\n0.563483 0.736297 0.727145 S\n0.077126 0.978141 0.092784 S\n0.448993 0.252885 0.969074 S\n0.871325 0.137776 0.459196 S\n0.877768 0.499983 0.487283 S\n0.970468 0.415466 0.955863 S\n0.281582 0.972067 0.679426 S\n0.273947 0.611661 0.154423 S\n0.529532 0.415466 0.455863 S\n0.754682 0.249911 0.106063 S\n0.051007 0.252885 0.469074 S\n0.254682 0.750089 0.393937 S\n0.628675 0.137776 0.959196 S\n0.371325 0.862224 0.040804 S\n0.773947 0.388339 0.345577 S\n0.577126 0.021859 0.407216 S\n0.245318 0.750089 0.893937 S\n0.781582 0.027933 0.820574 S\n",
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{
"id": "mp-1235597",
"created_at": "2022-09-04T14:42:07.637572Z",
"structure_string": "Li1 Mn9 Cd1 O10\n1.0\n-4.492850 2.620255 2.174893\n2.322069 -5.209379 6.625560\n4.474436 2.536043 2.223199\nLi Mn Cd O\n1 9 1 10\ndirect\n0.642027 0.234609 0.313149 Li\n0.437496 0.459150 0.242654 Mn\n0.000774 0.007621 0.000967 Mn\n0.522253 0.956322 0.539249 Mn\n0.969328 0.610064 0.186492 Mn\n0.071046 0.167566 0.435345 Mn\n0.505360 0.201524 0.875628 Mn\n0.521139 0.576123 0.714529 Mn\n0.995718 0.386718 0.786443 Mn\n0.015069 0.773460 0.626719 Mn\n0.510333 0.809284 0.127929 Cd\n0.731298 0.056140 0.221923 O\n0.715894 0.416553 0.039465 O\n0.776834 0.169552 0.672785 O\n0.780617 0.555337 0.493265 O\n0.261156 0.221873 0.134864 O\n0.177152 0.828587 0.312480 O\n0.744914 0.792889 0.824215 O\n0.255272 0.995918 0.742589 O\n0.265520 0.386011 0.558686 O\n0.219847 0.597826 0.924434 O\n",
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{
"id": "mp-1209151",
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"structure_string": "Si8 Mo16 Pt10\n1.0\n6.779592 4.029003 -1.341096\n6.779592 -4.029003 -1.341096\n0.031190 0.000000 -9.672090\nSi Mo Pt\n8 16 10\ndirect\n0.291217 0.025337 0.808034 Si\n0.025337 0.291217 0.308034 Si\n0.807771 0.500241 0.822964 Si\n0.500241 0.807771 0.322964 Si\n0.923869 0.392970 0.559088 Si\n0.392970 0.923869 0.059088 Si\n0.819377 0.022620 0.807390 Si\n0.022620 0.819377 0.307390 Si\n0.535108 0.128528 0.633312 Mo\n0.128528 0.535108 0.133312 Mo\n0.414928 0.592621 0.915092 Mo\n0.592621 0.414928 0.415092 Mo\n0.079039 0.902272 0.015504 Mo\n0.902272 0.079039 0.515504 Mo\n0.555286 0.757639 0.608285 Mo\n0.757639 0.555286 0.108285 Mo\n0.906598 0.752142 0.606074 Mo\n0.752142 0.906598 0.106074 Mo\n0.267783 0.087384 0.507353 Mo\n0.087384 0.267783 0.007353 Mo\n0.416915 0.280265 0.914348 Mo\n0.280265 0.416915 0.414348 Mo\n0.631174 0.030570 0.394553 Mo\n0.030570 0.631174 0.894553 Mo\n0.364946 0.152886 0.209264 Pt\n0.152886 0.364946 0.709264 Pt\n0.747445 0.256682 0.973803 Pt\n0.256682 0.747445 0.473803 Pt\n0.163656 0.855784 0.724685 Pt\n0.855784 0.163656 0.224685 Pt\n0.635754 0.839346 0.861296 Pt\n0.839346 0.635754 0.361296 Pt\n0.648521 0.375524 0.694354 Pt\n0.375524 0.648521 0.194354 Pt\n",
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